#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f88 n ASN 2 N 0.00 0.00 -3.74 7.83 3.02 -1.26 -4.33 115.26 116.78 1f88 n ASN 2 Ca 0.00 -1.33 -0.07 0.00 -0.03 0.00 0.00 54.58 53.14 1f88 n ASN 2 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 1f88 n ASN 2 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1f88 s GLY 3 N -1.34 -0.03 -0.23 7.41 0.00 -1.26 -4.07 107.32 107.80 1f88 s GLY 3 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1f88 s GLY 3 CO 0.00 -0.12 -0.05 -1.59 0.00 0.00 0.00 173.10 171.35 1f88 s THR 4 N -3.72 1.43 0.16 0.90 2.01 -0.52 -4.55 115.64 111.34 1f88 s THR 4 Ca 0.12 -1.13 -0.09 0.00 0.31 0.00 0.00 61.69 60.90 1f88 s THR 4 Cb -0.06 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.69 1f88 s THR 4 CO 0.08 -0.09 0.47 -0.70 -0.69 0.00 0.00 174.62 173.69 1f88 s GLU 5 N 1.45 3.77 0.33 4.92 2.12 -1.26 -0.93 118.70 129.11 1f88 s GLU 5 Ca -0.05 0.20 0.04 0.00 0.36 0.00 0.00 54.97 55.52 1f88 s GLU 5 Cb -0.18 -2.82 -0.06 0.00 0.26 0.00 0.00 34.13 31.32 1f88 s GLU 5 CO -0.06 0.44 0.06 0.20 -0.54 0.00 0.00 175.26 175.35 1f88 s GLY 6 N -2.14 2.12 0.58 -1.50 0.00 -0.75 -4.95 107.32 100.69 1f88 s GLY 6 Ca 0.41 -2.00 0.32 0.00 0.00 0.00 0.00 44.72 43.44 1f88 s GLY 6 CO 0.21 -1.83 2.22 -0.56 0.00 0.00 0.00 173.10 173.14 1f88 h PRO 7 N 2.08 0.00 0.00 2.90 0.13 -2.07 -3.21 132.00 131.84 1f88 h PRO 7 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1f88 h PRO 7 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1f88 h PRO 7 CO 0.69 0.03 0.00 0.27 -0.23 0.00 0.00 178.00 178.77 1f88 n ASN 8 N -3.65 0.47 -2.78 1.44 2.04 -1.26 -5.11 115.26 106.41 1f88 n ASN 8 Ca -0.03 -1.22 -0.16 0.00 -0.44 0.00 0.00 54.58 52.74 1f88 n ASN 8 Cb 0.13 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.32 1f88 n ASN 8 CO 0.00 0.00 0.00 2.22 -0.44 0.00 0.00 177.26 179.04 1f88 n PHE 9 N -0.11 -0.64 -3.09 -2.53 1.16 -1.21 -4.78 117.46 106.26 1f88 n PHE 9 Ca 0.00 -2.24 0.03 0.00 -1.87 0.00 0.00 57.45 53.37 1f88 n PHE 9 Cb 0.41 0.23 -0.00 0.00 -1.61 0.00 0.00 39.48 38.51 1f88 n PHE 9 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 1f88 s TYR 10 N -3.08 -1.16 -0.26 2.97 5.04 -1.26 -1.81 117.35 117.79 1f88 s TYR 10 Ca 0.32 0.47 -0.21 0.00 -2.44 0.00 0.00 57.07 55.21 1f88 s TYR 10 Cb 0.02 0.20 -0.01 0.00 0.35 0.00 0.00 41.96 42.52 1f88 s TYR 10 CO 0.23 -0.72 0.68 0.08 -1.34 0.00 0.00 175.55 174.48 1f88 s VAL 11 N 2.48 4.94 -0.62 3.14 1.01 -0.10 -4.91 120.40 126.34 1f88 s VAL 11 Ca 0.17 1.22 -0.08 0.00 0.00 0.00 0.00 61.98 63.29 1f88 s VAL 11 Cb -0.04 -3.99 -0.07 0.00 0.00 0.00 0.00 36.38 32.28 1f88 s VAL 11 CO -0.19 -0.02 1.78 -2.65 0.00 0.00 0.00 175.10 174.03 1f88 n PRO 12 N 5.81 1.37 -3.63 2.72 -0.02 -1.26 -1.44 135.00 138.55 1f88 n PRO 12 Ca 0.01 -1.26 -0.13 0.00 -2.02 0.00 0.00 63.50 60.10 1f88 n PRO 12 Cb 0.49 -2.42 -0.07 0.00 -0.02 0.00 0.00 33.50 31.48 1f88 n PRO 12 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1f88 s PHE 13 N 4.25 -0.70 0.06 6.00 2.19 -1.26 -4.16 117.98 124.37 1f88 s PHE 13 Ca 0.34 1.68 -0.30 0.00 0.33 0.00 0.00 56.93 58.97 1f88 s PHE 13 Cb 0.09 0.30 -0.05 0.00 -1.31 0.00 0.00 43.02 42.05 1f88 s PHE 13 CO 0.02 -0.35 1.16 0.45 1.83 0.00 0.00 175.22 178.33 1f88 s SER 14 N 0.25 7.13 -0.35 6.13 0.15 -1.26 -2.60 113.70 123.15 1f88 s SER 14 Ca 0.00 1.96 0.01 0.00 0.70 0.00 0.00 55.95 58.62 1f88 s SER 14 Cb -0.05 -2.58 0.38 0.00 -1.71 0.00 0.00 66.02 62.06 1f88 s SER 14 CO -0.00 -0.42 1.77 -3.20 1.20 0.00 0.00 173.24 172.59 1f88 n ASN 15 N 3.85 4.90 0.18 5.45 5.15 -1.26 -4.07 115.26 129.45 1f88 n ASN 15 Ca 0.08 -3.15 0.06 0.00 -0.60 0.00 0.00 54.58 50.97 1f88 n ASN 15 Cb 0.47 -0.85 0.15 0.00 -0.53 0.00 0.00 39.78 39.02 1f88 n ASN 15 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 1f88 h LYS 16 N 1.06 0.00 -0.01 1.20 3.11 -1.91 -2.72 116.57 117.31 1f88 h LYS 16 Ca 0.41 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.25 1f88 h LYS 16 Cb 1.66 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.89 1f88 h LYS 16 CO 0.85 0.33 -0.22 0.25 -2.81 0.00 0.00 179.45 177.85 1f88 n THR 17 N -3.23 0.00 -2.15 1.00 -2.24 -1.26 -4.94 114.28 101.47 1f88 n THR 17 Ca 0.02 -0.12 -0.20 0.00 -2.27 0.00 0.00 64.05 61.48 1f88 n THR 17 Cb 0.62 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 1f88 n THR 17 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f88 n GLY 18 N 1.32 0.25 0.00 3.38 0.00 -1.03 -4.86 105.19 104.27 1f88 n GLY 18 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.22 1f88 n GLY 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1f88 n VAL 19 N -3.45 0.00 -1.94 1.61 3.14 -1.26 -4.97 118.33 111.46 1f88 n VAL 19 Ca -0.23 -0.29 -0.42 0.00 -2.96 0.00 0.00 64.34 60.44 1f88 n VAL 19 Cb 0.67 0.38 -0.03 0.00 -1.06 0.00 0.00 33.84 33.81 1f88 n VAL 19 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1f88 s VAL 20 N -2.82 3.26 0.22 1.55 1.01 -1.26 -5.00 120.40 117.36 1f88 s VAL 20 Ca -0.03 0.54 0.12 0.00 0.00 0.00 0.00 61.98 62.60 1f88 s VAL 20 Cb 0.09 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 1f88 s VAL 20 CO 0.59 -0.02 -0.23 -0.13 0.00 0.00 0.00 175.10 175.31 1f88 s ARG 21 N 3.37 1.56 0.40 2.72 3.00 -1.26 -5.04 118.95 123.69 1f88 s ARG 21 Ca 0.75 -1.59 -0.27 0.00 0.00 0.00 0.00 55.73 54.62 1f88 s ARG 21 Cb -0.37 -1.82 -0.10 0.00 0.00 0.00 0.00 34.95 32.66 1f88 s ARG 21 CO 0.32 0.38 1.48 0.45 0.00 0.00 0.00 175.30 177.93 1f88 n SER 22 N 0.03 3.69 0.00 0.23 2.88 -1.26 -4.87 113.62 114.31 1f88 n SER 22 Ca -0.10 1.20 0.08 0.00 -1.33 0.00 0.00 58.87 58.72 1f88 n SER 22 Cb 0.57 -1.62 0.49 0.00 -0.75 0.00 0.00 64.21 62.90 1f88 n SER 22 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1f88 n PRO 23 N 0.27 0.52 -0.00 -1.46 -0.02 -1.26 -2.16 135.00 130.89 1f88 n PRO 23 Ca 0.02 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.55 1f88 n PRO 23 Cb 0.40 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.31 1f88 n PRO 23 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1f88 n PHE 24 N -1.00 0.00 -0.00 6.00 3.72 -1.26 0.11 117.46 125.03 1f88 n PHE 24 Ca 0.12 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.52 1f88 n PHE 24 Cb 0.06 -0.12 -0.01 0.00 -0.94 0.00 0.00 39.48 38.47 1f88 n PHE 24 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1f88 n GLU 25 N -1.56 3.75 -3.87 -1.08 1.02 -0.95 -4.68 120.64 113.27 1f88 n GLU 25 Ca -0.00 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1f88 n GLU 25 Cb 0.22 -1.02 -0.11 0.00 -0.02 0.00 0.00 31.44 30.51 1f88 n GLU 25 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1f88 s ALA 26 N -2.02 -0.28 0.57 0.62 0.00 -0.92 -5.03 121.76 114.71 1f88 s ALA 26 Ca -0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 51.96 51.74 1f88 s ALA 26 Cb 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 23.12 23.07 1f88 s ALA 26 CO 0.03 -0.16 1.02 -0.35 0.00 0.00 0.00 175.76 176.30 1f88 n PRO 27 N 1.97 1.07 -0.99 0.00 -0.04 -1.26 -4.48 135.00 131.26 1f88 n PRO 27 Ca -0.20 0.41 -0.21 0.00 -0.04 0.00 0.00 63.50 63.46 1f88 n PRO 27 Cb 0.57 -2.20 0.11 0.00 -0.04 0.00 0.00 33.50 31.93 1f88 n PRO 27 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1f88 n GLN 28 N -0.84 2.05 0.00 0.54 1.13 0.16 -4.58 117.38 115.84 1f88 n GLN 28 Ca 0.13 -2.33 0.04 0.00 -1.94 0.00 0.00 57.00 52.90 1f88 n GLN 28 Cb 0.46 -1.91 0.20 0.00 0.11 0.00 0.00 30.24 29.10 1f88 n GLN 28 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1f88 n TYR 29 N -0.58 0.00 1.64 1.08 4.01 -1.26 -1.21 117.16 120.84 1f88 n TYR 29 Ca 0.46 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 58.34 1f88 n TYR 29 Cb 1.11 -0.39 0.64 0.00 -0.31 0.00 0.00 39.34 40.39 1f88 n TYR 29 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 1f88 n TYR 30 N -1.39 0.01 -0.11 -0.72 0.18 -1.26 -3.82 117.16 110.05 1f88 n TYR 30 Ca 0.03 -0.01 -0.24 0.00 1.88 0.00 0.00 57.90 59.57 1f88 n TYR 30 Cb 0.08 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 38.93 1f88 n TYR 30 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1f88 n LEU 31 N -0.18 1.96 -4.12 -3.48 4.77 -0.35 -5.04 117.00 110.57 1f88 n LEU 31 Ca 0.20 0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 56.45 1f88 n LEU 31 Cb 0.28 -0.93 -0.09 0.00 -2.33 0.00 0.00 43.42 40.35 1f88 n LEU 31 CO 0.17 0.41 -0.13 0.00 -1.33 0.00 0.00 177.39 176.50 1f88 s ALA 32 N -2.42 0.67 0.81 -1.18 0.00 -1.25 -4.95 121.76 113.44 1f88 s ALA 32 Ca -0.31 -1.38 -0.11 0.00 0.00 0.00 0.00 51.96 50.16 1f88 s ALA 32 Cb 0.09 1.16 0.08 0.00 0.00 0.00 0.00 23.12 24.44 1f88 s ALA 32 CO 0.57 -0.63 1.09 -1.21 0.00 0.00 0.00 175.76 175.58 1f88 s GLU 33 N -4.09 1.98 0.05 0.00 8.01 -1.26 -4.51 118.70 118.88 1f88 s GLU 33 Ca 0.30 1.05 0.13 0.00 0.01 0.00 0.00 54.97 56.47 1f88 s GLU 33 Cb 0.05 -1.87 0.58 0.00 -4.31 0.00 0.00 34.13 28.58 1f88 s GLU 33 CO 0.08 -1.80 1.42 -2.30 0.01 0.00 0.00 175.26 172.67 1f88 n PRO 34 N -3.62 0.03 0.10 0.39 -0.02 -1.26 -2.83 135.00 127.80 1f88 n PRO 34 Ca 0.08 0.33 -0.16 0.00 -2.02 0.00 0.00 63.50 61.73 1f88 n PRO 34 Cb 0.54 -1.57 -0.14 0.00 -0.02 0.00 0.00 33.50 32.31 1f88 n PRO 34 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1f88 h TRP 35 N 0.00 0.50 0.00 6.00 5.08 -1.99 -3.09 115.95 122.44 1f88 h TRP 35 Ca 0.00 -0.37 -0.04 0.00 1.08 0.00 0.00 58.89 59.57 1f88 h TRP 35 Cb 0.21 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 26.35 1f88 h TRP 35 CO 0.00 1.30 -0.18 1.96 -1.28 0.00 0.00 178.44 180.23 1f88 h GLN 36 N 0.08 0.00 0.18 0.12 4.20 -1.90 0.03 115.11 117.81 1f88 h GLN 36 Ca -0.15 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.30 1f88 h GLN 36 Cb 1.98 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.79 1f88 h GLN 36 CO 0.20 0.18 -1.11 0.74 -0.67 0.00 0.00 178.83 178.18 1f88 h PHE 37 N 0.00 0.78 0.00 2.96 0.04 -1.64 -2.33 116.94 116.74 1f88 h PHE 37 Ca -0.00 -0.55 -0.07 0.00 2.80 0.00 0.00 57.97 60.15 1f88 h PHE 37 Cb 0.68 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 1f88 h PHE 37 CO 0.00 1.42 -0.34 0.77 -0.60 0.00 0.00 178.31 179.56 1f88 h SER 38 N -0.08 0.00 -0.36 2.17 0.02 -1.45 -1.15 113.55 112.70 1f88 h SER 38 Ca -0.19 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 1f88 h SER 38 Cb 1.86 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.39 1f88 h SER 38 CO 0.21 0.34 -0.11 -0.03 -1.14 0.00 0.00 176.83 176.09 1f88 h MET 39 N 0.00 0.72 -0.59 3.45 -1.53 -1.00 -1.18 114.93 114.80 1f88 h MET 39 Ca -0.00 -0.29 -0.06 0.00 -3.44 0.00 0.00 59.70 55.91 1f88 h MET 39 Cb 0.92 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.91 1f88 h MET 39 CO 0.04 0.88 0.13 -0.07 0.14 0.00 0.00 176.91 178.04 1f88 h LEU 40 N 0.51 0.91 -1.71 3.39 3.38 -1.14 -1.86 115.31 118.79 1f88 h LEU 40 Ca 0.09 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1f88 h LEU 40 Cb 0.63 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1f88 h LEU 40 CO 0.04 0.91 -0.12 0.00 0.09 0.00 0.00 178.44 179.37 1f88 h ALA 41 N 1.03 1.13 0.12 1.53 0.00 -1.04 -0.83 119.26 121.20 1f88 h ALA 41 Ca 0.18 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1f88 h ALA 41 Cb 0.37 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.16 1f88 h ALA 41 CO 0.00 0.15 -0.81 0.00 0.00 0.00 0.00 179.25 178.59 1f88 h ALA 42 N 1.88 -0.07 -0.26 0.00 0.00 -0.78 -2.38 119.26 117.65 1f88 h ALA 42 Ca -0.00 -0.68 0.03 0.00 0.00 0.00 0.00 54.91 54.26 1f88 h ALA 42 Cb 0.45 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1f88 h ALA 42 CO 0.02 0.38 0.07 -0.92 0.00 0.00 0.00 179.25 178.80 1f88 h TYR 43 N -0.31 0.12 -0.12 0.00 -0.00 -1.12 -0.09 116.97 115.44 1f88 h TYR 43 Ca -0.14 0.01 -0.04 0.00 -0.00 0.00 0.00 58.73 58.56 1f88 h TYR 43 Cb 1.61 -0.02 -0.01 0.00 -0.00 0.00 0.00 36.73 38.32 1f88 h TYR 43 CO 0.19 0.05 -0.13 0.52 -0.00 0.00 0.00 178.16 178.79 1f88 h MET 44 N 0.18 0.19 -0.31 1.82 2.86 -1.23 0.68 114.93 119.12 1f88 h MET 44 Ca 0.12 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.56 1f88 h MET 44 Cb 0.11 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1f88 h MET 44 CO -0.14 0.33 -0.44 0.35 1.06 0.00 0.00 176.91 178.07 1f88 h PHE 45 N 0.19 0.95 -0.03 -0.22 3.04 -0.71 -2.00 116.94 118.15 1f88 h PHE 45 Ca 0.04 -0.30 -0.01 0.00 3.98 0.00 0.00 57.97 61.68 1f88 h PHE 45 Cb 0.34 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.66 1f88 h PHE 45 CO 0.00 1.08 -0.01 -0.07 -2.02 0.00 0.00 178.31 177.29 1f88 h LEU 46 N 0.63 0.06 -1.73 0.59 3.38 -0.18 -1.09 115.31 116.97 1f88 h LEU 46 Ca 0.04 -0.40 0.14 0.00 0.09 0.00 0.00 57.88 57.75 1f88 h LEU 46 Cb 1.01 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1f88 h LEU 46 CO 0.10 0.44 0.44 -0.07 0.09 0.00 0.00 178.44 179.44 1f88 h LEU 47 N -0.33 0.26 -0.00 1.67 3.38 -0.88 -1.65 115.31 117.76 1f88 h LEU 47 Ca 0.01 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1f88 h LEU 47 Cb 0.42 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1f88 h LEU 47 CO 0.00 0.14 -0.01 0.40 0.09 0.00 0.00 178.44 179.06 1f88 h ILE 48 N 0.28 1.57 0.00 1.22 2.04 -1.18 0.27 117.51 121.71 1f88 h ILE 48 Ca 0.31 -1.70 0.00 0.00 1.00 0.00 0.00 64.86 64.48 1f88 h ILE 48 Cb 0.83 2.71 0.00 0.00 -0.74 0.00 0.00 36.82 39.63 1f88 h ILE 48 CO -0.07 0.44 0.00 0.23 0.00 0.00 0.00 178.15 178.75 1f88 n MET 49 N -4.73 0.68 -0.00 2.37 2.81 -0.43 -2.00 117.12 115.82 1f88 n MET 49 Ca -0.09 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.79 1f88 n MET 49 Cb 0.36 -1.38 -0.00 0.00 -0.71 0.00 0.00 33.22 31.49 1f88 n MET 49 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1f88 n LEU 50 N -0.88 1.61 0.25 4.03 0.00 -0.69 -4.53 117.00 116.79 1f88 n LEU 50 Ca 0.12 0.00 0.09 0.00 0.00 0.00 0.00 56.01 56.22 1f88 n LEU 50 Cb 0.06 -0.02 0.64 0.00 0.00 0.00 0.00 43.42 44.10 1f88 n LEU 50 CO 0.09 0.28 1.07 1.23 0.00 0.00 0.00 177.39 180.06 1f88 h GLY 51 N 0.01 0.00 0.22 -3.96 0.00 -0.42 -1.65 103.07 97.29 1f88 h GLY 51 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1f88 h GLY 51 CO -0.01 0.00 -0.11 -2.75 0.00 0.00 0.00 176.54 173.68 1f88 h PHE 52 N 0.00 -0.28 -0.51 5.60 -0.00 -1.60 -2.89 116.94 117.27 1f88 h PHE 52 Ca 0.01 -0.01 0.05 0.00 -0.00 0.00 0.00 57.97 58.03 1f88 h PHE 52 Cb 0.04 0.09 -0.05 0.00 -0.00 0.00 0.00 35.95 36.03 1f88 h PHE 52 CO 0.00 -0.17 0.24 -1.35 -0.00 0.00 0.00 178.31 177.02 1f88 h PRO 53 N -1.00 0.45 -0.60 6.41 0.11 -1.78 -0.09 132.00 135.50 1f88 h PRO 53 Ca -0.03 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.96 1f88 h PRO 53 Cb 0.23 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 1f88 h PRO 53 CO 0.05 0.30 -0.00 0.97 -0.21 0.00 0.00 178.00 179.10 1f88 h ILE 54 N 0.46 1.26 0.25 4.15 2.10 -1.46 0.37 117.51 124.64 1f88 h ILE 54 Ca 0.23 -1.15 -0.33 0.00 1.08 0.00 0.00 64.86 64.69 1f88 h ILE 54 Cb 0.18 0.80 0.04 0.00 -1.09 0.00 0.00 36.82 36.75 1f88 h ILE 54 CO -0.19 0.42 -1.47 0.78 -1.08 0.00 0.00 178.15 176.61 1f88 h ASN 55 N 0.96 0.82 -0.07 2.19 2.35 -1.41 -3.02 115.58 117.39 1f88 h ASN 55 Ca 0.17 -0.88 -0.15 0.00 -0.55 0.00 0.00 56.30 54.89 1f88 h ASN 55 Cb 0.55 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1f88 h ASN 55 CO 0.03 1.69 -0.47 0.15 -1.65 0.00 0.00 177.43 177.18 1f88 h PHE 56 N 0.14 0.76 0.21 1.19 3.04 -0.97 -0.56 116.94 120.76 1f88 h PHE 56 Ca -0.25 -0.24 -0.00 0.00 3.98 0.00 0.00 57.97 61.45 1f88 h PHE 56 Cb 2.16 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 40.51 1f88 h PHE 56 CO 0.12 0.97 -0.15 1.25 -2.02 0.00 0.00 178.31 178.49 1f88 h LEU 57 N 0.50 -0.39 -0.70 0.59 5.85 -0.36 0.28 115.31 121.08 1f88 h LEU 57 Ca 0.03 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.92 1f88 h LEU 57 Cb 1.01 0.12 -0.10 0.00 0.37 0.00 0.00 40.66 42.06 1f88 h LEU 57 CO 0.09 -0.24 0.17 0.74 -0.34 0.00 0.00 178.44 178.86 1f88 h THR 58 N -0.37 0.56 -0.42 1.05 2.02 -1.39 0.11 112.91 114.48 1f88 h THR 58 Ca -0.01 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 1f88 h THR 58 Cb 0.32 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1f88 h THR 58 CO 0.00 0.05 0.15 0.25 0.37 0.00 0.00 175.52 176.34 1f88 h LEU 59 N 0.27 0.59 -1.48 2.58 6.46 -0.63 -2.75 115.31 120.35 1f88 h LEU 59 Ca 0.38 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.94 1f88 h LEU 59 Cb 0.62 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1f88 h LEU 59 CO -0.47 0.61 -0.11 0.22 -0.62 0.00 0.00 178.44 178.07 1f88 h TYR 60 N 0.53 0.00 0.00 1.25 5.03 0.17 -2.82 116.97 121.13 1f88 h TYR 60 Ca 0.14 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.43 1f88 h TYR 60 Cb 0.22 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.50 1f88 h TYR 60 CO 0.00 0.11 -0.14 0.28 -1.32 0.00 0.00 178.16 177.10 1f88 h VAL 61 N 0.00 0.67 -0.65 1.81 2.07 -0.68 -1.92 116.25 117.55 1f88 h VAL 61 Ca -0.00 -1.54 0.05 0.00 0.82 0.00 0.00 66.70 66.03 1f88 h VAL 61 Cb 0.55 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1f88 h VAL 61 CO 0.01 0.23 0.43 0.71 0.02 0.00 0.00 177.57 178.97 1f88 h THR 62 N -1.00 1.04 -0.08 2.57 1.35 -1.57 0.83 112.91 116.06 1f88 h THR 62 Ca -0.02 -0.24 -0.02 0.00 -0.55 0.00 0.00 66.41 65.57 1f88 h THR 62 Cb 0.48 0.28 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1f88 h THR 62 CO -0.01 0.13 -0.05 0.58 -0.25 0.00 0.00 175.52 175.91 1f88 h VAL 63 N 0.70 1.34 -0.51 6.82 2.07 -1.64 -3.27 116.25 121.78 1f88 h VAL 63 Ca 0.27 -1.12 -0.09 0.00 0.82 0.00 0.00 66.70 66.58 1f88 h VAL 63 Cb 0.19 1.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1f88 h VAL 63 CO -0.08 0.31 -0.06 -0.61 0.02 0.00 0.00 177.57 177.15 1f88 h GLN 64 N -0.23 0.90 -6.02 1.57 4.15 -0.40 -3.42 115.11 111.66 1f88 h GLN 64 Ca 0.02 -0.29 -0.60 0.00 0.77 0.00 0.00 58.65 58.55 1f88 h GLN 64 Cb 0.52 -0.08 -0.10 0.00 0.21 0.00 0.00 27.48 28.03 1f88 h GLN 64 CO 0.01 0.93 0.53 -1.01 -1.93 0.00 0.00 178.83 177.36 1f88 s HIS 65 N -4.90 3.04 0.33 3.99 3.76 0.28 -4.94 115.29 116.85 1f88 s HIS 65 Ca -0.10 0.59 0.08 0.00 -0.15 0.00 0.00 55.06 55.48 1f88 s HIS 65 Cb 0.14 -3.68 0.79 0.00 1.11 0.00 0.00 32.58 30.94 1f88 s HIS 65 CO 0.84 -0.89 1.82 1.57 -0.85 0.00 0.00 174.74 177.23 1f88 h LYS 66 N 8.66 0.70 -1.00 1.40 -0.00 -1.84 -2.56 116.57 121.93 1f88 h LYS 66 Ca -0.24 -0.04 -0.46 0.00 -0.00 0.00 0.00 60.65 59.91 1f88 h LYS 66 Cb 1.08 -0.16 -0.28 0.00 -0.00 0.00 0.00 32.23 32.88 1f88 h LYS 66 CO 0.98 0.46 0.59 1.63 -0.00 0.00 0.00 179.45 183.11 1f88 n LYS 67 N -4.65 2.12 -3.75 0.07 5.02 -1.26 -4.70 118.16 111.00 1f88 n LYS 67 Ca 0.21 -2.68 -0.28 0.00 -2.02 0.00 0.00 58.31 53.54 1f88 n LYS 67 Cb 0.55 -2.05 -0.11 0.00 -0.02 0.00 0.00 35.03 33.40 1f88 n LYS 67 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1f88 n LEU 68 N -0.96 3.10 -1.87 -0.35 4.32 -0.97 -4.88 117.00 115.38 1f88 n LEU 68 Ca 0.53 -5.25 0.01 0.00 -0.02 0.00 0.00 56.01 51.29 1f88 n LEU 68 Cb 1.54 -0.68 0.05 0.00 -1.62 0.00 0.00 43.42 42.71 1f88 n LEU 68 CO 0.54 1.84 0.08 0.54 -1.22 0.00 0.00 177.39 179.18 1f88 n ARG 69 N 1.68 0.99 -2.34 3.23 5.12 -1.26 -4.88 116.66 119.20 1f88 n ARG 69 Ca 0.23 -2.79 -0.32 0.00 -1.93 0.00 0.00 57.85 53.04 1f88 n ARG 69 Cb 0.37 -0.86 -0.03 0.00 -1.16 0.00 0.00 32.46 30.78 1f88 n ARG 69 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1f88 s THR 70 N -1.91 4.52 0.35 0.55 2.01 -1.26 -4.48 115.64 115.43 1f88 s THR 70 Ca 0.33 1.18 0.11 0.00 0.31 0.00 0.00 61.69 63.62 1f88 s THR 70 Cb 0.37 -3.72 0.34 0.00 0.01 0.00 0.00 72.50 69.49 1f88 s THR 70 CO -0.10 -0.72 1.82 -0.65 -0.69 0.00 0.00 174.62 174.27 1f88 h PRO 71 N 0.80 0.60 -0.10 4.92 0.11 -1.99 0.20 132.00 136.54 1f88 h PRO 71 Ca -0.47 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.63 1f88 h PRO 71 Cb 1.19 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1f88 h PRO 71 CO 0.61 0.40 -0.04 1.25 -0.21 0.00 0.00 178.00 180.01 1f88 h LEU 72 N 0.62 -0.13 -1.87 2.35 5.85 -1.98 0.39 115.31 120.54 1f88 h LEU 72 Ca 0.52 0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.31 1f88 h LEU 72 Cb 1.00 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1f88 h LEU 72 CO -0.28 -0.05 0.16 0.78 -0.34 0.00 0.00 178.44 178.71 1f88 h ASN 73 N -0.02 0.14 0.05 1.25 -0.26 -1.06 0.35 115.58 116.03 1f88 h ASN 73 Ca 0.05 -0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1f88 h ASN 73 Cb 0.10 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.33 1f88 h ASN 73 CO -0.11 0.10 -0.02 1.88 -1.06 0.00 0.00 177.43 178.21 1f88 h TYR 74 N 0.16 -0.06 -0.54 1.19 0.05 0.32 -2.53 116.97 115.56 1f88 h TYR 74 Ca 0.10 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.89 1f88 h TYR 74 Cb 0.19 0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.91 1f88 h TYR 74 CO -0.00 0.58 0.34 0.82 -1.05 0.00 0.00 178.16 178.84 1f88 h ILE 75 N -0.85 1.09 0.00 -2.88 2.04 0.22 -0.92 117.51 116.22 1f88 h ILE 75 Ca -0.01 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 1f88 h ILE 75 Cb 0.66 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1f88 h ILE 75 CO 0.01 0.12 -0.10 -0.07 0.00 0.00 0.00 178.15 178.12 1f88 h LEU 76 N 0.68 0.00 -0.02 1.44 -0.00 -0.42 -1.21 115.31 115.78 1f88 h LEU 76 Ca 0.21 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.91 1f88 h LEU 76 Cb -0.02 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.65 1f88 h LEU 76 CO -0.07 0.10 -0.69 0.25 -0.00 0.00 0.00 178.44 178.02 1f88 h LEU 77 N 0.00 0.65 0.06 1.67 5.85 -0.84 -2.82 115.31 119.88 1f88 h LEU 77 Ca -0.00 -0.73 0.01 0.00 0.84 0.00 0.00 57.88 58.00 1f88 h LEU 77 Cb 0.38 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1f88 h LEU 77 CO 0.01 1.29 -0.42 -1.13 -0.34 0.00 0.00 178.44 177.85 1f88 h ASN 78 N 0.06 -1.28 -1.01 1.25 -1.24 -0.10 -0.15 115.58 113.11 1f88 h ASN 78 Ca -0.08 0.14 0.22 0.00 0.71 0.00 0.00 56.30 57.29 1f88 h ASN 78 Cb 1.38 0.48 -0.12 0.00 0.73 0.00 0.00 38.32 40.79 1f88 h ASN 78 CO 0.14 -0.43 0.60 -0.07 -1.29 0.00 0.00 177.43 176.38 1f88 h LEU 79 N -0.57 0.73 -1.30 0.34 3.38 -1.37 0.61 115.31 117.12 1f88 h LEU 79 Ca 0.00 0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1f88 h LEU 79 Cb 0.59 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1f88 h LEU 79 CO -0.25 0.19 0.08 0.00 0.09 0.00 0.00 178.44 178.55 1f88 h ALA 80 N 1.69 1.44 0.05 1.53 0.00 -0.87 0.71 119.26 123.81 1f88 h ALA 80 Ca 0.61 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 55.12 1f88 h ALA 80 Cb 1.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1f88 h ALA 80 CO -0.43 0.41 -1.21 0.28 0.00 0.00 0.00 179.25 178.30 1f88 h VAL 81 N 0.54 1.50 0.01 0.00 2.07 0.18 -2.45 116.25 118.09 1f88 h VAL 81 Ca 0.12 -3.18 -0.21 0.00 0.82 0.00 0.00 66.70 64.26 1f88 h VAL 81 Cb 0.23 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1f88 h VAL 81 CO -0.00 0.88 -0.90 0.00 0.02 0.00 0.00 177.57 177.57 1f88 h ALA 82 N 0.83 0.47 -0.01 1.67 0.00 -0.36 -2.66 119.26 119.20 1f88 h ALA 82 Ca -0.10 -0.73 -0.10 0.00 0.00 0.00 0.00 54.91 53.98 1f88 h ALA 82 Cb 1.88 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1f88 h ALA 82 CO 0.15 0.90 -0.48 -0.44 0.00 0.00 0.00 179.25 179.38 1f88 h ASP 83 N 0.14 0.04 -0.10 0.00 5.19 0.38 -0.59 116.42 121.48 1f88 h ASP 83 Ca -0.05 -0.02 -0.21 0.00 -0.62 0.00 0.00 57.03 56.13 1f88 h ASP 83 Cb 1.54 -0.01 0.01 0.00 0.18 0.00 0.00 39.33 41.04 1f88 h ASP 83 CO 0.14 0.51 -0.72 -0.07 -3.12 0.00 0.00 179.24 175.98 1f88 h LEU 84 N 0.03 0.86 -0.31 1.55 3.38 -1.31 -1.99 115.31 117.52 1f88 h LEU 84 Ca -0.00 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.41 1f88 h LEU 84 Cb 0.85 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1f88 h LEU 84 CO 0.06 1.33 0.11 -0.26 0.09 0.00 0.00 178.44 179.77 1f88 h PHE 85 N 0.52 0.49 -0.33 1.13 0.05 -1.26 0.22 116.94 117.76 1f88 h PHE 85 Ca -0.03 -0.04 0.07 0.00 3.82 0.00 0.00 57.97 61.79 1f88 h PHE 85 Cb 1.33 -0.14 -0.08 0.00 2.00 0.00 0.00 35.95 39.05 1f88 h PHE 85 CO 0.07 0.49 -0.27 0.52 -0.18 0.00 0.00 178.31 178.94 1f88 h MET 86 N 0.35 -0.23 -0.28 1.51 2.86 -1.07 0.81 114.93 118.88 1f88 h MET 86 Ca 0.10 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1f88 h MET 86 Cb 0.22 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1f88 h MET 86 CO -0.01 -0.15 0.16 0.28 1.06 0.00 0.00 176.91 178.25 1f88 h VAL 87 N -0.24 1.03 0.13 -2.22 2.07 -0.91 0.27 116.25 116.38 1f88 h VAL 87 Ca 0.16 -0.11 -0.37 0.00 0.82 0.00 0.00 66.70 67.21 1f88 h VAL 87 Cb 0.50 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1f88 h VAL 87 CO -0.47 0.06 -1.99 0.49 0.02 0.00 0.00 177.57 175.68 1f88 n PHE 88 N -4.94 1.30 0.00 1.57 3.01 0.03 -2.50 117.46 115.94 1f88 n PHE 88 Ca -0.01 0.27 -0.12 0.00 1.01 0.00 0.00 57.45 58.60 1f88 n PHE 88 Cb 0.05 -1.17 -0.09 0.00 -0.01 0.00 0.00 39.48 38.25 1f88 n PHE 88 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1f88 h GLY 89 N 1.08 -0.10 0.00 1.37 0.00 0.53 -3.37 103.07 102.59 1f88 h GLY 89 Ca -0.42 0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1f88 h GLY 89 CO 0.09 -0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.21 1f88 n GLY 90 N 0.69 0.16 0.50 4.60 0.00 0.54 -4.40 105.19 107.27 1f88 n GLY 90 Ca -0.08 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.19 1f88 n GLY 90 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1f88 h PHE 91 N 0.00 0.00 -0.01 1.61 0.05 -0.58 0.17 116.94 118.17 1f88 h PHE 91 Ca 0.00 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.79 1f88 h PHE 91 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 1f88 h PHE 91 CO 0.00 0.00 0.00 1.15 -0.18 0.00 0.00 178.31 179.28 1f88 h THR 92 N 0.00 1.15 -0.15 -1.55 2.02 -1.64 -1.98 112.91 110.75 1f88 h THR 92 Ca 0.41 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 1f88 h THR 92 Cb 2.55 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 70.38 1f88 h THR 92 CO -0.00 0.11 -0.15 0.74 0.37 0.00 0.00 175.52 176.59 1f88 h THR 93 N -0.17 1.34 0.00 3.16 2.02 -0.87 -2.91 112.91 115.48 1f88 h THR 93 Ca 0.00 -1.30 -0.02 0.00 0.77 0.00 0.00 66.41 65.86 1f88 h THR 93 Cb 0.18 1.86 -0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1f88 h THR 93 CO -0.00 0.38 -0.11 0.00 0.37 0.00 0.00 175.52 176.17 1f88 h THR 94 N -0.00 0.86 0.08 3.16 1.03 -1.56 0.32 112.91 116.79 1f88 h THR 94 Ca 0.02 -0.39 -0.00 0.00 -0.01 0.00 0.00 66.41 66.03 1f88 h THR 94 Cb 0.68 1.23 0.00 0.00 -1.07 0.00 0.00 68.15 68.98 1f88 h THR 94 CO 0.04 0.10 -0.04 0.25 -0.01 0.00 0.00 175.52 175.86 1f88 h LEU 95 N 0.00 -0.09 -0.91 0.00 5.85 -1.29 -2.89 115.31 115.98 1f88 h LEU 95 Ca -0.00 -0.42 -0.05 0.00 0.84 0.00 0.00 57.88 58.25 1f88 h LEU 95 Cb 0.22 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1f88 h LEU 95 CO 0.01 0.39 -0.23 1.88 -0.34 0.00 0.00 178.44 180.16 1f88 h TYR 96 N -0.60 0.00 -0.16 1.25 0.05 -1.27 -2.85 116.97 113.38 1f88 h TYR 96 Ca -0.01 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 1f88 h TYR 96 Cb 0.50 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.24 1f88 h TYR 96 CO 0.08 0.23 -0.05 1.15 -1.05 0.00 0.00 178.16 178.52 1f88 h THR 97 N 0.00 1.30 -0.58 -2.88 2.02 -0.39 -2.97 112.91 109.40 1f88 h THR 97 Ca -0.00 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.09 1f88 h THR 97 Cb 0.83 1.65 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 1f88 h THR 97 CO 0.03 0.31 0.20 0.28 0.37 0.00 0.00 175.52 176.71 1f88 h SER 98 N 0.02 0.79 0.16 4.18 0.02 -1.49 0.89 113.55 118.12 1f88 h SER 98 Ca 0.04 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1f88 h SER 98 Cb 0.50 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1f88 h SER 98 CO 0.02 0.73 0.00 0.18 -1.14 0.00 0.00 176.83 176.62 1f88 n LEU 99 N -4.31 0.00 0.00 5.07 4.77 -1.08 -1.86 117.00 119.59 1f88 n LEU 99 Ca 0.05 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1f88 n LEU 99 Cb 0.19 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1f88 n LEU 99 CO 0.39 -0.19 0.06 1.41 -1.33 0.00 0.00 177.39 177.74 1f88 n HIS 100 N -1.27 0.00 -1.23 -1.77 8.25 -0.43 -5.01 115.22 113.76 1f88 n HIS 100 Ca 0.05 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.43 1f88 n HIS 100 Cb 0.07 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 1f88 n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f88 n GLY 101 N 0.34 0.95 3.68 -1.41 0.00 0.18 -4.34 105.19 104.59 1f88 n GLY 101 Ca 0.00 -0.39 0.03 0.00 0.00 0.00 0.00 46.02 45.66 1f88 n GLY 101 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f88 s TYR 102 N -2.15 -0.01 -1.13 1.61 1.13 -0.87 0.37 117.35 116.29 1f88 s TYR 102 Ca 0.00 -0.05 -0.21 0.00 -1.41 0.00 0.00 57.07 55.40 1f88 s TYR 102 Cb 0.00 0.53 0.03 0.00 -1.10 0.00 0.00 41.96 41.42 1f88 s TYR 102 CO 0.00 -0.15 1.66 -0.06 -2.51 0.00 0.00 175.55 174.49 1f88 s PHE 103 N -2.18 2.49 0.30 -3.49 0.40 0.31 -4.55 117.98 111.26 1f88 s PHE 103 Ca 0.18 -0.86 0.05 0.00 -0.60 0.00 0.00 56.93 55.71 1f88 s PHE 103 Cb 0.05 -4.58 0.48 0.00 0.51 0.00 0.00 43.02 39.47 1f88 s PHE 103 CO -0.05 -1.79 1.73 -0.39 0.70 0.00 0.00 175.22 175.42 1f88 h VAL 104 N 6.31 1.28 0.00 -0.44 -1.51 -1.83 -2.60 116.25 117.46 1f88 h VAL 104 Ca 0.29 -1.36 0.00 0.00 -1.23 0.00 0.00 66.70 64.40 1f88 h VAL 104 Cb 0.95 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 1f88 h VAL 104 CO 1.40 0.41 0.00 0.49 -1.23 0.00 0.00 177.57 178.64 1f88 n PHE 105 N -4.08 0.00 -4.07 5.19 0.99 -1.26 -5.00 117.46 109.22 1f88 n PHE 105 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 1f88 n PHE 105 Cb 0.43 -0.12 0.00 0.00 -1.00 0.00 0.00 39.48 38.80 1f88 n PHE 105 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1f88 n GLY 106 N 0.52 -1.08 0.15 1.37 0.00 -0.98 -3.71 105.19 101.45 1f88 n GLY 106 Ca 0.15 -1.23 -0.03 0.00 0.00 0.00 0.00 46.02 44.91 1f88 n GLY 106 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1f88 h PRO 107 N 0.00 0.08 -0.15 1.61 0.11 -1.95 -2.68 132.00 129.03 1f88 h PRO 107 Ca 0.00 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.10 1f88 h PRO 107 Cb 0.00 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1f88 h PRO 107 CO 0.00 0.67 0.11 1.15 -0.21 0.00 0.00 178.00 179.72 1f88 h THR 108 N 0.06 0.90 0.09 -1.15 2.02 -2.00 0.31 112.91 113.14 1f88 h THR 108 Ca -0.01 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.90 1f88 h THR 108 Cb 1.10 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1f88 h THR 108 CO 0.08 0.00 -1.29 1.23 0.37 0.00 0.00 175.52 175.91 1f88 h GLY 109 N 0.00 0.22 1.50 2.16 0.00 -1.58 -2.18 103.07 103.18 1f88 h GLY 109 Ca 0.07 -0.56 -0.14 0.00 0.00 0.00 0.00 47.33 46.70 1f88 h GLY 109 CO -0.00 0.49 -0.46 0.00 0.00 0.00 0.00 176.54 176.58 1f88 h ASN 111 N 0.44 0.52 -0.47 0.00 2.35 -0.53 -1.88 115.58 116.02 1f88 h ASN 111 Ca 0.03 -0.51 0.03 0.00 -0.55 0.00 0.00 56.30 55.30 1f88 h ASN 111 Cb 0.97 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 39.15 1f88 h ASN 111 CO 0.09 0.93 0.25 -0.07 -1.65 0.00 0.00 177.43 176.97 1f88 h LEU 112 N 0.13 0.37 -0.58 1.61 3.38 -1.32 0.11 115.31 119.00 1f88 h LEU 112 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1f88 h LEU 112 Cb 0.81 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1f88 h LEU 112 CO 0.06 0.26 0.38 -0.08 0.09 0.00 0.00 178.44 179.15 1f88 h GLU 113 N 0.49 0.77 0.15 1.13 4.22 -1.12 -3.09 114.58 117.12 1f88 h GLU 113 Ca 0.20 -0.05 -0.24 0.00 0.08 0.00 0.00 59.36 59.35 1f88 h GLU 113 Cb 0.09 -0.17 0.02 0.00 0.50 0.00 0.00 28.75 29.18 1f88 h GLU 113 CO -0.13 0.52 -1.11 0.78 -2.18 0.00 0.00 179.01 176.89 1f88 h GLY 114 N 0.79 0.36 0.44 1.92 0.00 -1.06 -3.28 103.07 102.24 1f88 h GLY 114 Ca 0.21 -0.93 0.03 0.00 0.00 0.00 0.00 47.33 46.64 1f88 h GLY 114 CO -0.05 0.81 -0.27 -2.75 0.00 0.00 0.00 176.54 174.29 1f88 h PHE 115 N -0.27 -0.72 0.00 5.60 3.04 -0.85 0.26 116.94 123.99 1f88 h PHE 115 Ca -0.21 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.74 1f88 h PHE 115 Cb 1.76 0.31 -0.00 0.00 2.56 0.00 0.00 35.95 40.58 1f88 h PHE 115 CO 0.16 -0.36 -0.08 0.74 -2.02 0.00 0.00 178.31 176.75 1f88 h PHE 116 N -0.43 0.00 0.21 0.41 0.04 -1.73 0.52 116.94 115.96 1f88 h PHE 116 Ca 0.05 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.48 1f88 h PHE 116 Cb 0.50 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.67 1f88 h PHE 116 CO -0.28 0.08 -1.61 0.00 -0.60 0.00 0.00 178.31 175.90 1f88 h ALA 117 N 1.92 0.03 -0.02 2.45 0.00 -1.54 -0.61 119.26 121.49 1f88 h ALA 117 Ca -0.00 -1.02 -0.22 0.00 0.00 0.00 0.00 54.91 53.67 1f88 h ALA 117 Cb 0.46 0.32 0.02 0.00 0.00 0.00 0.00 17.79 18.58 1f88 h ALA 117 CO 0.01 0.90 -0.84 1.15 0.00 0.00 0.00 179.25 180.47 1f88 h THR 118 N 0.12 1.33 -0.35 0.00 2.02 -0.71 -1.11 112.91 114.22 1f88 h THR 118 Ca -0.29 -2.14 -0.00 0.00 0.77 0.00 0.00 66.41 64.75 1f88 h THR 118 Cb 2.12 2.40 -0.02 0.00 -1.74 0.00 0.00 68.15 70.91 1f88 h THR 118 CO 0.22 0.65 0.21 0.25 0.37 0.00 0.00 175.52 177.22 1f88 h LEU 119 N 0.23 0.41 0.16 2.58 5.85 -0.06 0.48 115.31 124.97 1f88 h LEU 119 Ca -0.10 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1f88 h LEU 119 Cb 1.51 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1f88 h LEU 119 CO 0.17 0.34 -0.33 1.23 -0.34 0.00 0.00 178.44 179.50 1f88 h GLY 120 N 0.46 -1.14 1.29 3.75 0.00 -1.00 0.14 103.07 106.56 1f88 h GLY 120 Ca 0.13 0.56 0.01 0.00 0.00 0.00 0.00 47.33 48.02 1f88 h GLY 120 CO -0.02 -0.34 0.48 -1.33 0.00 0.00 0.00 176.54 175.33 1f88 h GLY 121 N -0.53 1.02 1.62 4.60 0.00 -1.16 -2.42 103.07 106.19 1f88 h GLY 121 Ca -0.02 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.82 1f88 h GLY 121 CO -0.13 0.37 -0.34 0.83 0.00 0.00 0.00 176.54 177.27 1f88 h GLU 122 N 0.98 0.43 -0.32 4.80 4.39 -0.50 0.22 114.58 124.58 1f88 h GLU 122 Ca 0.27 -0.19 -0.10 0.00 0.34 0.00 0.00 59.36 59.67 1f88 h GLU 122 Cb -0.11 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1f88 h GLU 122 CO -0.06 0.72 -0.24 0.82 -1.16 0.00 0.00 179.01 179.09 1f88 h ILE 123 N 0.37 1.27 -0.07 3.13 2.04 -0.32 0.17 117.51 124.10 1f88 h ILE 123 Ca 0.04 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 1f88 h ILE 123 Cb 0.78 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1f88 h ILE 123 CO 0.06 0.42 -0.04 0.00 0.00 0.00 0.00 178.15 178.60 1f88 h ALA 124 N 1.19 0.09 -0.97 1.87 0.00 -1.06 0.87 119.26 121.25 1f88 h ALA 124 Ca 0.08 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1f88 h ALA 124 Cb 0.70 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1f88 h ALA 124 CO 0.05 -0.14 0.64 1.25 0.00 0.00 0.00 179.25 181.05 1f88 h LEU 125 N -0.25 1.08 0.00 0.00 7.12 -0.44 0.84 115.31 123.65 1f88 h LEU 125 Ca 0.01 -0.02 -0.19 0.00 0.13 0.00 0.00 57.88 57.82 1f88 h LEU 125 Cb 0.50 -0.25 -0.03 0.00 -0.53 0.00 0.00 40.66 40.35 1f88 h LEU 125 CO 0.01 0.75 -0.92 -0.50 -0.13 0.00 0.00 178.44 177.65 1f88 h TRP 126 N 1.26 0.00 0.00 1.25 4.06 -0.50 -3.00 115.95 119.02 1f88 h TRP 126 Ca 0.38 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 61.18 1f88 h TRP 126 Cb -0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.09 1f88 h TRP 126 CO -0.00 0.91 -0.71 0.77 -3.56 0.00 0.00 178.44 175.85 1f88 h SER 127 N 0.00 0.00 0.79 -3.49 0.02 0.11 -2.06 113.55 108.92 1f88 h SER 127 Ca -0.01 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 1f88 h SER 127 Cb 1.70 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.24 1f88 h SER 127 CO 0.12 0.71 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.32 1f88 h LEU 128 N 0.00 0.00 0.01 5.07 3.38 -0.83 -1.80 115.31 121.14 1f88 h LEU 128 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1f88 h LEU 128 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1f88 h LEU 128 CO 0.09 0.13 -0.08 0.58 0.09 0.00 0.00 178.44 179.26 1f88 h VAL 129 N 0.00 1.70 -0.11 1.22 2.07 -1.32 -2.36 116.25 117.45 1f88 h VAL 129 Ca -0.00 -2.15 0.03 0.00 0.82 0.00 0.00 66.70 65.40 1f88 h VAL 129 Cb 0.57 3.15 -0.00 0.00 -1.52 0.00 0.00 31.29 33.48 1f88 h VAL 129 CO 0.02 0.57 0.11 0.58 0.02 0.00 0.00 177.57 178.86 1f88 h VAL 130 N -0.83 0.62 0.17 2.57 2.07 -1.16 -2.42 116.25 117.26 1f88 h VAL 130 Ca -0.01 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.23 1f88 h VAL 130 Cb 0.97 0.92 0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1f88 h VAL 130 CO 0.02 0.00 -1.31 -0.07 0.02 0.00 0.00 177.57 176.23 1f88 h LEU 131 N 0.00 0.56 -0.67 2.57 3.38 -1.39 -3.27 115.31 116.49 1f88 h LEU 131 Ca 0.05 -0.91 0.08 0.00 0.09 0.00 0.00 57.88 57.19 1f88 h LEU 131 Cb 0.27 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1f88 h LEU 131 CO -0.00 1.60 0.33 0.00 0.09 0.00 0.00 178.44 180.47 1f88 h ALA 132 N 0.06 0.90 -0.30 1.53 0.00 -0.91 -2.10 119.26 118.43 1f88 h ALA 132 Ca -0.25 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1f88 h ALA 132 Cb 1.88 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 1f88 h ALA 132 CO 0.16 -0.04 0.04 0.82 0.00 0.00 0.00 179.25 180.23 1f88 h ILE 133 N 0.59 1.24 -0.80 0.00 2.04 -1.69 -2.65 117.51 116.25 1f88 h ILE 133 Ca 0.32 -0.83 0.15 0.00 1.00 0.00 0.00 64.86 65.49 1f88 h ILE 133 Cb 0.29 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 1f88 h ILE 133 CO -0.24 0.27 0.53 -0.08 0.00 0.00 0.00 178.15 178.63 1f88 h GLU 134 N 0.32 0.49 0.00 2.37 4.81 -1.51 0.40 114.58 121.46 1f88 h GLU 134 Ca 0.09 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1f88 h GLU 134 Cb 0.36 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1f88 h GLU 134 CO 0.01 0.32 0.00 0.54 -0.73 0.00 0.00 179.01 179.15 1f88 n ARG 135 N -4.50 0.24 0.01 1.92 5.12 -0.83 -0.35 116.66 118.26 1f88 n ARG 135 Ca 0.15 0.23 0.12 0.00 -1.93 0.00 0.00 57.85 56.42 1f88 n ARG 135 Cb 0.51 -1.80 0.19 0.00 -1.16 0.00 0.00 32.46 30.20 1f88 n ARG 135 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1f88 n TYR 136 N -2.22 0.08 -0.07 -1.55 9.36 0.13 -3.24 117.16 119.64 1f88 n TYR 136 Ca 0.05 0.02 -0.09 0.00 3.32 0.00 0.00 57.90 61.21 1f88 n TYR 136 Cb 0.40 -0.29 -0.10 0.00 -0.63 0.00 0.00 39.34 38.73 1f88 n TYR 136 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1f88 n VAL 137 N -1.61 0.96 0.43 2.97 0.31 -0.27 -2.76 118.33 118.37 1f88 n VAL 137 Ca 0.05 -0.52 0.11 0.00 -0.01 0.00 0.00 64.34 63.98 1f88 n VAL 137 Cb 0.35 -0.80 0.18 0.00 -0.91 0.00 0.00 33.84 32.66 1f88 n VAL 137 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1f88 n VAL 138 N -2.68 0.39 0.00 2.52 0.24 0.52 -3.04 118.33 116.29 1f88 n VAL 138 Ca -0.25 -0.70 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 1f88 n VAL 138 Cb 0.91 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 34.36 1f88 n VAL 138 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1f88 n VAL 139 N 1.38 0.00 1.28 3.34 0.31 -1.20 -4.74 118.33 118.70 1f88 n VAL 139 Ca 0.17 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.63 1f88 n VAL 139 Cb 0.58 -0.44 0.34 0.00 -0.91 0.00 0.00 33.84 33.41 1f88 n VAL 139 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1f88 n LYS 141 N 0.46 0.00 -0.07 0.00 4.01 -1.11 -4.84 118.16 116.61 1f88 n LYS 141 Ca 0.16 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.85 1f88 n LYS 141 Cb 0.44 0.00 -0.09 0.00 -0.51 0.00 0.00 35.03 34.87 1f88 n LYS 141 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 1f88 h PRO 142 N 1.20 0.00 0.00 1.97 0.11 -1.72 -3.50 132.00 130.06 1f88 h PRO 142 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1f88 h PRO 142 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1f88 h PRO 142 CO 0.00 0.74 0.00 1.19 -0.21 0.00 0.00 178.00 179.72 1f88 n PHE 148 N -4.63 0.00 -2.02 0.65 3.72 -1.26 -5.09 117.46 108.83 1f88 n PHE 148 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1f88 n PHE 148 Cb 0.38 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.92 1f88 n PHE 148 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1f88 n GLY 149 N -0.33 -0.56 0.00 1.37 0.00 -1.26 -4.06 105.19 100.35 1f88 n GLY 149 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1f88 n GLY 149 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1f88 n GLU 150 N 0.00 0.04 0.00 1.61 1.02 -1.26 -2.50 120.64 119.55 1f88 n GLU 150 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1f88 n GLU 150 Cb 0.00 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1f88 n GLU 150 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1f88 n ASN 151 N -0.78 0.00 0.14 1.62 4.13 -1.26 -4.63 115.26 114.49 1f88 n ASN 151 Ca 0.01 0.00 0.01 0.00 1.68 0.00 0.00 54.58 56.27 1f88 n ASN 151 Cb 0.00 -0.24 0.16 0.00 -1.54 0.00 0.00 39.78 38.15 1f88 n ASN 151 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 1f88 h HIS 152 N 0.00 0.00 0.00 3.10 3.86 -1.74 -3.15 115.15 117.21 1f88 h HIS 152 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 1f88 h HIS 152 Cb 0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1f88 h HIS 152 CO 0.00 0.58 -0.26 0.00 0.86 0.00 0.00 177.93 179.11 1f88 h ALA 153 N 1.42 1.26 0.00 2.45 0.00 -1.80 -1.54 119.26 121.05 1f88 h ALA 153 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1f88 h ALA 153 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1f88 h ALA 153 CO 0.08 0.33 -0.02 -0.89 0.00 0.00 0.00 179.25 178.75 1f88 n ILE 154 N -3.79 0.38 -0.01 0.00 5.41 -1.19 -1.20 119.36 118.96 1f88 n ILE 154 Ca -0.01 -0.19 -0.14 0.00 1.00 0.00 0.00 62.75 63.41 1f88 n ILE 154 Cb 0.36 -0.54 -0.14 0.00 -0.71 0.00 0.00 39.64 38.61 1f88 n ILE 154 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 1f88 n MET 155 N -1.99 0.69 -0.08 0.38 2.81 -0.68 -1.97 117.12 116.28 1f88 n MET 155 Ca 0.06 0.28 -0.13 0.00 -1.81 0.00 0.00 57.70 56.10 1f88 n MET 155 Cb 0.40 -1.75 -0.05 0.00 -0.71 0.00 0.00 33.22 31.10 1f88 n MET 155 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1f88 h GLY 156 N 2.41 0.66 1.43 3.03 0.00 -1.27 0.43 103.07 109.76 1f88 h GLY 156 Ca -0.35 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.26 1f88 h GLY 156 CO 0.08 0.63 0.20 -2.08 0.00 0.00 0.00 176.54 175.37 1f88 h VAL 157 N 0.32 1.19 -0.03 4.60 2.07 -1.28 0.18 116.25 123.30 1f88 h VAL 157 Ca 0.04 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 66.84 1f88 h VAL 157 Cb 0.83 0.59 0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1f88 h VAL 157 CO 0.07 0.23 -0.46 0.00 0.02 0.00 0.00 177.57 177.43 1f88 h ALA 158 N 1.50 0.10 -0.52 1.67 0.00 -1.19 -3.21 119.26 117.61 1f88 h ALA 158 Ca 0.17 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.63 1f88 h ALA 158 Cb 0.15 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1f88 h ALA 158 CO -0.02 0.27 0.34 0.35 0.00 0.00 0.00 179.25 180.20 1f88 h PHE 159 N -0.15 0.48 -0.26 0.00 3.57 0.38 -1.31 116.94 119.65 1f88 h PHE 159 Ca -0.05 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.39 1f88 h PHE 159 Cb 1.15 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1f88 h PHE 159 CO 0.14 0.26 -0.16 1.79 -2.23 0.00 0.00 178.31 178.11 1f88 h THR 160 N 0.48 1.24 -0.01 4.41 1.35 -0.66 -0.15 112.91 119.57 1f88 h THR 160 Ca 0.22 -1.07 -0.24 0.00 -0.55 0.00 0.00 66.41 64.77 1f88 h THR 160 Cb 0.26 1.22 0.01 0.00 -1.73 0.00 0.00 68.15 67.91 1f88 h THR 160 CO -0.06 0.35 -0.96 -0.50 -0.25 0.00 0.00 175.52 174.10 1f88 h TRP 161 N 0.42 0.79 0.31 4.73 4.06 -1.31 -0.17 115.95 124.78 1f88 h TRP 161 Ca 0.07 -0.42 -0.02 0.00 2.06 0.00 0.00 58.89 60.59 1f88 h TRP 161 Cb 0.53 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 1f88 h TRP 161 CO 0.02 1.25 -0.15 0.28 -3.56 0.00 0.00 178.44 176.27 1f88 h VAL 162 N 0.31 0.71 -0.09 1.49 2.07 -0.98 0.28 116.25 120.04 1f88 h VAL 162 Ca -0.09 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1f88 h VAL 162 Cb 1.60 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1f88 h VAL 162 CO 0.18 0.03 0.01 0.24 0.02 0.00 0.00 177.57 178.04 1f88 h MET 163 N -0.49 0.15 -0.47 1.57 2.86 -1.11 -1.40 114.93 116.04 1f88 h MET 163 Ca -0.04 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1f88 h MET 163 Cb 0.37 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 1f88 h MET 163 CO 0.07 0.40 0.29 0.00 1.06 0.00 0.00 176.91 178.73 1f88 h ALA 164 N 0.75 0.59 0.00 6.32 0.00 -1.03 -1.84 119.26 124.05 1f88 h ALA 164 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1f88 h ALA 164 Cb 0.32 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1f88 h ALA 164 CO 0.00 0.00 -0.07 -0.07 0.00 0.00 0.00 179.25 179.11 1f88 h LEU 165 N 0.60 0.00 0.00 0.00 3.38 -0.35 0.53 115.31 119.47 1f88 h LEU 165 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1f88 h LEU 165 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1f88 h LEU 165 CO -0.06 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.54 1f88 n ALA 166 N -2.50 2.10 -0.03 1.53 0.00 -0.54 -1.27 120.51 119.80 1f88 n ALA 166 Ca -0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.25 1f88 n ALA 166 Cb 0.15 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.27 1f88 n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f88 h ALA 168 N -0.16 0.98 0.23 0.00 0.00 -1.21 -3.38 119.26 115.73 1f88 h ALA 168 Ca -0.16 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.38 1f88 h ALA 168 Cb 1.17 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.98 1f88 h ALA 168 CO -0.07 0.05 -1.52 0.00 0.00 0.00 0.00 179.25 177.71 1f88 h ALA 169 N 1.96 -0.08 -0.50 0.00 0.00 -1.41 -3.40 119.26 115.82 1f88 h ALA 169 Ca -0.00 -0.92 0.09 0.00 0.00 0.00 0.00 54.91 54.08 1f88 h ALA 169 Cb 0.99 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 1f88 h ALA 169 CO 0.01 0.78 0.06 -1.35 0.00 0.00 0.00 179.25 178.74 1f88 h PRO 170 N 0.14 0.17 0.00 0.00 0.11 -1.77 -2.20 132.00 128.45 1f88 h PRO 170 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1f88 h PRO 170 Cb 2.15 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 33.22 1f88 h PRO 170 CO 0.25 0.11 0.00 -2.30 -0.21 0.00 0.00 178.00 175.86 1f88 n PRO 171 N -5.17 0.01 0.01 1.05 -0.02 -0.39 -0.95 135.00 129.55 1f88 n PRO 171 Ca 0.06 0.50 -0.07 0.00 -2.02 0.00 0.00 63.50 61.97 1f88 n PRO 171 Cb 0.26 -1.52 -0.12 0.00 -0.02 0.00 0.00 33.50 32.09 1f88 n PRO 171 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1f88 h LEU 172 N 0.00 0.00 0.00 2.45 3.38 -1.64 -3.37 115.31 116.13 1f88 h LEU 172 Ca 0.00 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.56 1f88 h LEU 172 Cb 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.69 1f88 h LEU 172 CO 0.00 0.92 -2.46 0.52 0.09 0.00 0.00 178.44 177.51 1f88 n VAL 173 N -3.08 1.45 0.00 1.22 0.31 -0.12 -5.01 118.33 113.09 1f88 n VAL 173 Ca -0.12 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1f88 n VAL 173 Cb 0.99 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 1f88 n VAL 173 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1f88 n GLY 174 N 1.84 0.00 3.16 2.92 0.00 -0.44 -5.11 105.19 107.56 1f88 n GLY 174 Ca -0.48 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 1f88 n GLY 174 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1f88 s TRP 175 N 0.00 3.29 0.17 1.61 -0.00 -0.81 -4.75 118.94 118.45 1f88 s TRP 175 Ca 0.00 -1.95 0.00 0.00 -0.00 0.00 0.00 56.10 54.15 1f88 s TRP 175 Cb 0.00 -2.17 0.00 0.00 -0.00 0.00 0.00 33.47 31.30 1f88 s TRP 175 CO 0.00 -0.82 0.00 0.45 -0.00 0.00 0.00 176.95 176.58 1f88 n SER 176 N 4.60 -4.28 -3.69 5.86 2.88 -1.21 -1.26 113.62 116.51 1f88 n SER 176 Ca -0.12 0.29 -0.14 0.00 -1.33 0.00 0.00 58.87 57.56 1f88 n SER 176 Cb 0.43 -2.18 -0.08 0.00 -0.75 0.00 0.00 64.21 61.63 1f88 n SER 176 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1f88 s ARG 177 N -1.63 0.74 0.03 -1.46 1.70 -1.26 -4.31 118.95 112.76 1f88 s ARG 177 Ca 0.00 0.06 -0.28 0.00 -0.47 0.00 0.00 55.73 55.04 1f88 s ARG 177 Cb 0.00 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.68 1f88 s ARG 177 CO 0.00 -0.20 0.88 0.71 -1.08 0.00 0.00 175.30 175.61 1f88 s TYR 178 N -1.03 3.70 -0.01 5.89 2.02 -1.26 -2.00 117.35 124.66 1f88 s TYR 178 Ca -0.11 1.60 0.00 0.00 -0.37 0.00 0.00 57.07 58.20 1f88 s TYR 178 Cb -0.04 -2.99 0.01 0.00 -0.40 0.00 0.00 41.96 38.55 1f88 s TYR 178 CO 0.05 0.12 -0.00 -1.50 -1.57 0.00 0.00 175.55 172.65 1f88 s ILE 179 N 0.51 0.07 0.15 2.71 2.07 -0.44 -4.88 121.20 121.39 1f88 s ILE 179 Ca 0.46 0.03 -0.34 0.00 -1.41 0.00 0.00 60.65 59.39 1f88 s ILE 179 Cb -0.21 -0.12 -0.15 0.00 0.13 0.00 0.00 42.46 42.11 1f88 s ILE 179 CO 0.26 0.06 1.43 -0.81 -1.91 0.00 0.00 174.94 173.97 1f88 n PRO 180 N 3.50 1.69 -4.22 3.50 -0.04 -1.26 -2.51 135.00 135.65 1f88 n PRO 180 Ca -0.18 0.61 -0.26 0.00 -0.04 0.00 0.00 63.50 63.62 1f88 n PRO 180 Cb 0.56 -2.29 -0.08 0.00 -0.04 0.00 0.00 33.50 31.65 1f88 n PRO 180 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1f88 s GLU 181 N 0.46 2.35 6.32 0.54 2.02 0.14 -4.68 118.70 125.86 1f88 s GLU 181 Ca 0.79 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 54.62 1f88 s GLU 181 Cb -0.79 -2.32 0.00 0.00 0.10 0.00 0.00 34.13 31.13 1f88 s GLU 181 CO 0.44 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.57 1f88 n GLY 182 N -0.16 3.88 0.71 -1.39 0.00 -1.26 -1.20 105.19 105.77 1f88 n GLY 182 Ca -0.10 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1f88 n GLY 182 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1f88 n MET 183 N 14.00 0.77 -3.86 1.61 2.81 -1.25 -4.65 117.12 126.55 1f88 n MET 183 Ca 0.00 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.63 1f88 n MET 183 Cb 0.00 -1.27 0.01 0.00 -0.71 0.00 0.00 33.22 31.25 1f88 n MET 183 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1f88 n GLN 184 N 0.33 -4.54 0.00 0.03 1.13 -0.34 -4.86 117.38 109.13 1f88 n GLN 184 Ca 0.00 0.54 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 1f88 n GLN 184 Cb 0.28 -5.09 0.00 0.00 0.11 0.00 0.00 30.24 25.53 1f88 n GLN 184 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1f88 s SER 186 N -1.50 2.72 0.04 0.00 1.04 -1.26 -4.75 113.70 110.01 1f88 s SER 186 Ca 0.00 -0.76 0.08 0.00 0.48 0.00 0.00 55.95 55.75 1f88 s SER 186 Cb 0.00 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.93 1f88 s SER 186 CO 0.00 0.05 -0.20 0.00 0.98 0.00 0.00 173.24 174.07 1f88 s GLY 188 N -1.43 0.72 0.38 0.00 0.00 -1.05 -4.14 107.32 101.80 1f88 s GLY 188 Ca 0.14 -0.98 -0.26 0.00 0.00 0.00 0.00 44.72 43.62 1f88 s GLY 188 CO 0.05 -0.61 1.14 1.39 0.00 0.00 0.00 173.10 175.07 1f88 n ILE 189 N -0.48 2.32 -1.97 0.90 -0.00 -1.26 -1.32 119.36 117.54 1f88 n ILE 189 Ca -0.03 -0.50 -0.25 0.00 -0.00 0.00 0.00 62.75 61.97 1f88 n ILE 189 Cb 0.61 -1.34 -0.07 0.00 -0.00 0.00 0.00 39.64 38.84 1f88 n ILE 189 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1f88 s ASP 190 N -0.56 4.74 0.11 4.38 3.68 -0.85 -4.64 116.67 123.53 1f88 s ASP 190 Ca 0.60 -1.37 0.10 0.00 2.13 0.00 0.00 52.55 54.02 1f88 s ASP 190 Cb -0.57 -2.59 -0.16 0.00 -1.45 0.00 0.00 42.92 38.16 1f88 s ASP 190 CO 0.59 -3.35 1.16 1.88 0.13 0.00 0.00 175.17 175.58 1f88 h TYR 191 N 10.34 0.00 -0.80 -5.34 0.05 -1.90 -3.38 116.97 115.93 1f88 h TYR 191 Ca 0.16 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.89 1f88 h TYR 191 Cb 0.96 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.66 1f88 h TYR 191 CO 1.18 0.88 0.32 1.88 -1.05 0.00 0.00 178.16 181.37 1f88 h TYR 192 N 0.00 1.22 -2.94 4.88 0.05 -1.86 -3.35 116.97 114.96 1f88 h TYR 192 Ca -0.07 -0.09 -0.53 0.00 0.05 0.00 0.00 58.73 58.08 1f88 h TYR 192 Cb 1.73 -0.37 -0.16 0.00 1.01 0.00 0.00 36.73 38.95 1f88 h TYR 192 CO 0.00 0.92 -0.77 0.95 -1.05 0.00 0.00 178.16 178.21 1f88 s THR 193 N -5.56 1.99 -0.09 -2.88 -4.23 -1.26 -4.64 115.64 98.97 1f88 s THR 193 Ca -0.12 -2.12 0.14 0.00 -1.18 0.00 0.00 61.69 58.41 1f88 s THR 193 Cb 0.16 -2.03 -0.07 0.00 1.34 0.00 0.00 72.50 71.90 1f88 s THR 193 CO 0.84 -0.39 1.15 -0.65 -0.54 0.00 0.00 174.62 175.02 1f88 h PRO 194 N 2.84 0.00 -4.67 3.99 0.11 -1.91 -3.42 132.00 128.95 1f88 h PRO 194 Ca -0.41 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.49 1f88 h PRO 194 Cb 1.22 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.34 1f88 h PRO 194 CO 0.56 0.50 -0.60 1.58 -0.21 0.00 0.00 178.00 179.83 1f88 n HIS 195 N -3.11 -1.26 -0.56 0.65 -0.00 -1.26 -3.63 115.22 106.04 1f88 n HIS 195 Ca -0.04 0.53 0.45 0.00 0.46 0.00 0.00 57.72 59.12 1f88 n HIS 195 Cb 0.82 -0.99 0.74 0.00 -0.12 0.00 0.00 29.99 30.45 1f88 n HIS 195 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1f88 h GLU 196 N 0.88 0.02 0.00 1.57 4.39 -1.98 -0.40 114.58 119.06 1f88 h GLU 196 Ca -0.30 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.39 1f88 h GLU 196 Cb 0.71 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1f88 h GLU 196 CO 0.13 0.01 -0.06 0.93 -1.16 0.00 0.00 179.01 178.87 1f88 h GLU 197 N 0.02 0.00 0.00 2.33 5.08 -2.02 -3.16 114.58 116.84 1f88 h GLU 197 Ca 0.88 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.24 1f88 h GLU 197 Cb 3.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.40 1f88 h GLU 197 CO -0.24 0.06 0.00 0.25 -1.00 0.00 0.00 179.01 178.08 1f88 n THR 198 N -4.18 0.00 -3.52 1.13 -2.24 -0.31 -5.05 114.28 100.10 1f88 n THR 198 Ca -0.03 -0.29 -0.20 0.00 -2.27 0.00 0.00 64.05 61.26 1f88 n THR 198 Cb 0.14 1.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1f88 n THR 198 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1f88 n ASN 199 N -0.08 -2.98 0.00 3.42 4.05 -0.33 -3.35 115.26 115.99 1f88 n ASN 199 Ca 0.00 -0.70 0.12 0.00 0.45 0.00 0.00 54.58 54.45 1f88 n ASN 199 Cb 0.09 -1.03 0.71 0.00 1.23 0.00 0.00 39.78 40.78 1f88 n ASN 199 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 1f88 n ASN 200 N -1.41 0.00 0.09 1.20 0.23 -1.24 -2.21 115.26 111.91 1f88 n ASN 200 Ca -0.17 -0.73 -0.11 0.00 -0.53 0.00 0.00 54.58 53.03 1f88 n ASN 200 Cb 0.43 -0.01 -0.07 0.00 -2.08 0.00 0.00 39.78 38.06 1f88 n ASN 200 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1f88 h GLU 201 N 0.00 0.22 0.00 -3.83 4.81 -1.82 -2.38 114.58 111.59 1f88 h GLU 201 Ca 0.00 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1f88 h GLU 201 Cb 0.01 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1f88 h GLU 201 CO 0.00 1.06 -0.95 0.66 -0.73 0.00 0.00 179.01 179.05 1f88 h SER 202 N 0.10 0.00 -0.02 1.04 4.64 -1.80 -3.22 113.55 114.30 1f88 h SER 202 Ca -0.07 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.01 1f88 h SER 202 Cb 1.68 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.79 1f88 h SER 202 CO 0.16 0.26 -0.93 0.15 -0.87 0.00 0.00 176.83 175.60 1f88 h PHE 203 N 0.00 0.97 -0.44 4.77 3.04 -1.52 -2.71 116.94 121.05 1f88 h PHE 203 Ca -0.06 -0.51 -0.08 0.00 3.98 0.00 0.00 57.97 61.31 1f88 h PHE 203 Cb 1.25 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 39.62 1f88 h PHE 203 CO 0.00 1.35 -0.03 0.28 -2.02 0.00 0.00 178.31 177.88 1f88 h VAL 204 N 0.31 1.24 0.00 1.41 2.07 -1.56 0.54 116.25 120.26 1f88 h VAL 204 Ca -0.11 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1f88 h VAL 204 Cb 1.59 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1f88 h VAL 204 CO 0.18 0.35 -0.16 0.40 0.02 0.00 0.00 177.57 178.37 1f88 h ILE 205 N 0.69 0.44 0.00 4.57 2.04 -1.59 -1.25 117.51 122.41 1f88 h ILE 205 Ca 0.13 -0.85 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 1f88 h ILE 205 Cb 0.47 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1f88 h ILE 205 CO 0.02 0.15 -0.57 0.22 0.00 0.00 0.00 178.15 177.97 1f88 h TYR 206 N 0.00 0.00 -0.92 1.37 5.03 -0.97 -3.28 116.97 118.19 1f88 h TYR 206 Ca -0.00 0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.33 1f88 h TYR 206 Cb 0.59 0.00 -0.05 0.00 1.55 0.00 0.00 36.73 38.82 1f88 h TYR 206 CO 0.00 0.95 0.61 1.98 -1.32 0.00 0.00 178.16 180.38 1f88 h MET 207 N -1.00 1.19 0.00 1.82 4.05 0.05 0.46 114.93 121.50 1f88 h MET 207 Ca -0.14 -0.07 -0.02 0.00 -0.28 0.00 0.00 59.70 59.19 1f88 h MET 207 Cb 0.94 -0.27 -0.00 0.00 -0.80 0.00 0.00 31.60 31.47 1f88 h MET 207 CO -0.09 0.79 -0.09 0.74 0.23 0.00 0.00 176.91 178.49 1f88 h PHE 208 N 1.23 0.00 0.00 1.39 0.04 -1.40 0.14 116.94 118.34 1f88 h PHE 208 Ca 0.35 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.67 1f88 h PHE 208 Cb -0.10 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 37.98 1f88 h PHE 208 CO -0.01 0.09 -2.50 1.33 -0.60 0.00 0.00 178.31 176.62 1f88 n VAL 209 N -3.32 1.53 0.68 -0.55 0.24 -0.74 -1.27 118.33 114.89 1f88 n VAL 209 Ca -0.01 -0.41 0.13 0.00 -2.04 0.00 0.00 64.34 62.01 1f88 n VAL 209 Cb 0.29 -1.80 0.33 0.00 -1.47 0.00 0.00 33.84 31.19 1f88 n VAL 209 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1f88 n VAL 210 N -4.07 0.39 -1.52 3.34 0.31 0.15 -2.05 118.33 114.87 1f88 n VAL 210 Ca -0.52 -0.23 0.04 0.00 -0.01 0.00 0.00 64.34 63.62 1f88 n VAL 210 Cb 0.90 -0.34 0.06 0.00 -0.91 0.00 0.00 33.84 33.55 1f88 n VAL 210 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1f88 n HIS 211 N -2.06 0.00 0.00 3.52 8.25 0.02 -4.67 115.22 120.29 1f88 n HIS 211 Ca 0.05 -0.43 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 1f88 n HIS 211 Cb 0.42 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1f88 n HIS 211 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1f88 n PHE 212 N -0.61 -0.37 0.05 4.41 7.35 -1.11 -4.90 117.46 122.29 1f88 n PHE 212 Ca 0.07 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.67 1f88 n PHE 212 Cb 0.66 0.20 -0.05 0.00 0.35 0.00 0.00 39.48 40.63 1f88 n PHE 212 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1f88 h ILE 213 N 0.00 0.00 0.66 -2.13 2.04 -1.28 -2.57 117.51 114.23 1f88 h ILE 213 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1f88 h ILE 213 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 1f88 h ILE 213 CO 0.00 0.00 -0.45 0.40 0.00 0.00 0.00 178.15 178.10 1f88 h ILE 214 N -0.37 0.09 -1.18 -0.67 2.04 -1.68 -1.33 117.51 114.41 1f88 h ILE 214 Ca -0.00 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.20 1f88 h ILE 214 Cb 0.38 0.09 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 1f88 h ILE 214 CO -0.15 0.00 0.92 -0.65 0.00 0.00 0.00 178.15 178.27 1f88 h PRO 215 N -1.06 0.00 0.00 2.37 0.11 -1.80 -0.54 132.00 131.08 1f88 h PRO 215 Ca -0.08 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1f88 h PRO 215 Cb 0.87 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 1f88 h PRO 215 CO 0.05 0.00 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.73 1f88 h LEU 216 N 0.00 0.00 -1.88 2.35 3.38 -1.00 -3.05 115.31 115.11 1f88 h LEU 216 Ca 0.56 -0.81 0.13 0.00 0.09 0.00 0.00 57.88 57.85 1f88 h LEU 216 Cb 2.40 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 43.12 1f88 h LEU 216 CO -0.01 0.93 0.38 0.40 0.09 0.00 0.00 178.44 180.23 1f88 h ILE 217 N -1.00 0.79 -0.48 1.22 2.04 -0.01 0.10 117.51 120.17 1f88 h ILE 217 Ca -0.01 -0.04 -0.14 0.00 1.00 0.00 0.00 64.86 65.67 1f88 h ILE 217 Cb 0.84 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1f88 h ILE 217 CO -0.01 0.02 -0.23 0.58 0.00 0.00 0.00 178.15 178.52 1f88 h VAL 218 N 0.13 1.27 0.00 1.67 2.07 -1.38 0.98 116.25 120.99 1f88 h VAL 218 Ca 0.26 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1f88 h VAL 218 Cb 0.85 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1f88 h VAL 218 CO -0.03 0.48 0.00 0.40 0.02 0.00 0.00 177.57 178.44 1f88 h ILE 219 N 0.86 0.00 0.00 4.57 2.04 -0.78 -2.91 117.51 121.29 1f88 h ILE 219 Ca 0.11 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1f88 h ILE 219 Cb 0.82 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1f88 h ILE 219 CO 0.07 0.00 -0.28 -0.26 0.00 0.00 0.00 178.15 177.68 1f88 h PHE 220 N 0.00 0.00 -0.27 1.37 0.05 -0.31 -3.23 116.94 114.55 1f88 h PHE 220 Ca 0.00 0.00 0.05 0.00 3.82 0.00 0.00 57.97 61.84 1f88 h PHE 220 Cb 0.58 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.51 1f88 h PHE 220 CO 0.00 0.00 0.18 0.35 -0.18 0.00 0.00 178.31 178.66 1f88 h PHE 221 N -0.68 0.14 -0.07 -0.55 3.57 -0.97 1.31 116.94 119.70 1f88 h PHE 221 Ca 0.00 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 1f88 h PHE 221 Cb 0.28 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1f88 h PHE 221 CO -0.12 0.08 -0.30 0.00 -2.23 0.00 0.00 178.31 175.73 1f88 h TYR 223 N 0.12 0.17 -0.17 0.00 3.20 -0.56 -3.32 116.97 116.40 1f88 h TYR 223 Ca 0.02 -0.12 -0.12 0.00 3.14 0.00 0.00 58.73 61.64 1f88 h TYR 223 Cb 0.60 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1f88 h TYR 223 CO 0.01 1.19 -0.41 0.78 -1.64 0.00 0.00 178.16 178.09 1f88 h GLY 224 N 2.70 0.42 -5.37 1.82 0.00 0.19 -3.18 103.07 99.65 1f88 h GLY 224 Ca -0.26 -0.41 -0.71 0.00 0.00 0.00 0.00 47.33 45.96 1f88 h GLY 224 CO 0.11 0.37 3.11 -1.06 0.00 0.00 0.00 176.54 179.07 1f88 n GLN 225 N -4.02 4.12 -3.90 4.80 6.02 0.68 -5.06 117.38 120.01 1f88 n GLN 225 Ca -0.02 -2.85 -0.09 0.00 -0.01 0.00 0.00 57.00 54.04 1f88 n GLN 225 Cb 0.50 -2.73 -0.01 0.00 1.02 0.00 0.00 30.24 29.01 1f88 n GLN 225 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1f88 s LEU 226 N -0.90 0.12 0.00 1.08 1.43 -1.21 -4.92 118.68 114.29 1f88 s LEU 226 Ca 0.61 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1f88 s LEU 226 Cb 0.18 2.40 0.00 0.00 0.03 0.00 0.00 46.19 48.80 1f88 s LEU 226 CO -0.08 -1.41 0.00 0.35 0.23 0.00 0.00 176.35 175.44 1f88 n THR 243 N -0.48 0.00 0.41 5.49 -2.24 -1.26 -5.07 114.28 111.13 1f88 n THR 243 Ca -0.04 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.79 1f88 n THR 243 Cb 0.60 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 69.08 1f88 n THR 243 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f88 n GLN 244 N -1.10 0.03 -0.00 -0.78 6.02 -1.26 -1.58 117.38 118.72 1f88 n GLN 244 Ca 0.00 0.28 0.04 0.00 -0.01 0.00 0.00 57.00 57.31 1f88 n GLN 244 Cb 0.00 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 29.71 1f88 n GLN 244 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1f88 n LYS 245 N -1.46 3.93 0.14 -1.09 0.00 -1.26 -4.53 118.16 113.90 1f88 n LYS 245 Ca 0.03 -0.01 0.04 0.00 -0.00 0.00 0.00 58.31 58.37 1f88 n LYS 245 Cb 0.12 -0.90 0.04 0.00 -0.00 0.00 0.00 35.03 34.28 1f88 n LYS 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1f88 h ALA 246 N 1.05 0.71 0.00 0.58 0.00 -1.77 -3.25 119.26 116.57 1f88 h ALA 246 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1f88 h ALA 246 Cb 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1f88 h ALA 246 CO 0.00 0.56 0.00 0.39 0.00 0.00 0.00 179.25 180.20 1f88 n GLU 247 N -3.19 0.04 0.11 0.00 -0.58 -1.21 -2.29 120.64 113.52 1f88 n GLU 247 Ca 0.02 0.33 -0.03 0.00 -0.42 0.00 0.00 57.16 57.06 1f88 n GLU 247 Cb 0.71 -1.58 0.09 0.00 -0.57 0.00 0.00 31.44 30.10 1f88 n GLU 247 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1f88 h LYS 248 N 0.00 0.01 0.00 3.49 1.63 -1.86 -2.43 116.57 117.40 1f88 h LYS 248 Ca 0.00 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1f88 h LYS 248 Cb 0.22 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.85 1f88 h LYS 248 CO 0.00 0.73 -0.93 0.93 -3.45 0.00 0.00 179.45 176.73 1f88 h GLU 249 N 0.00 0.00 0.00 1.90 4.39 -1.69 -0.91 114.58 118.27 1f88 h GLU 249 Ca -0.01 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 1f88 h GLU 249 Cb 1.28 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.91 1f88 h GLU 249 CO 0.09 0.06 -0.64 0.28 -1.16 0.00 0.00 179.01 177.64 1f88 h VAL 250 N 0.00 1.15 0.23 3.13 2.07 -1.57 -2.84 116.25 118.43 1f88 h VAL 250 Ca -0.03 -2.50 -0.01 0.00 0.82 0.00 0.00 66.70 64.98 1f88 h VAL 250 Cb 1.10 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 33.36 1f88 h VAL 250 CO 0.01 0.63 -0.11 0.74 0.02 0.00 0.00 177.57 178.86 1f88 h THR 251 N 0.00 0.34 -0.43 2.57 2.02 -1.43 -2.36 112.91 113.62 1f88 h THR 251 Ca -0.01 -0.92 0.12 0.00 0.77 0.00 0.00 66.41 66.38 1f88 h THR 251 Cb 1.43 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 1f88 h THR 251 CO 0.08 0.09 0.53 0.03 0.37 0.00 0.00 175.52 176.63 1f88 h ARG 252 N -1.02 0.00 0.22 6.66 3.08 -1.24 0.27 114.38 122.36 1f88 h ARG 252 Ca -0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1f88 h ARG 252 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1f88 h ARG 252 CO 0.05 0.00 -0.11 1.98 -1.07 0.00 0.00 179.97 180.83 1f88 h MET 253 N 0.00 -0.29 -0.80 0.04 4.05 -1.47 -2.31 114.93 114.15 1f88 h MET 253 Ca 0.20 0.02 0.18 0.00 -0.28 0.00 0.00 59.70 59.82 1f88 h MET 253 Cb 1.26 0.07 -0.11 0.00 -0.80 0.00 0.00 31.60 32.01 1f88 h MET 253 CO -0.00 -0.10 0.27 0.28 0.23 0.00 0.00 176.91 177.59 1f88 h VAL 254 N -1.05 0.53 -0.31 -5.77 2.07 -0.27 0.42 116.25 111.87 1f88 h VAL 254 Ca -0.03 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1f88 h VAL 254 Cb 0.32 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 1f88 h VAL 254 CO 0.05 0.06 0.11 0.40 0.02 0.00 0.00 177.57 178.22 1f88 h ILE 255 N 0.35 0.93 -0.49 4.57 1.08 -0.66 -1.18 117.51 122.11 1f88 h ILE 255 Ca 0.46 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.83 1f88 h ILE 255 Cb 0.80 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 35.18 1f88 h ILE 255 CO -0.50 0.05 0.24 0.40 -0.69 0.00 0.00 178.15 177.65 1f88 h ILE 256 N 0.26 1.19 -0.76 -0.67 5.03 -0.12 -2.05 117.51 120.38 1f88 h ILE 256 Ca 0.14 -0.55 0.10 0.00 -0.12 0.00 0.00 64.86 64.43 1f88 h ILE 256 Cb 0.10 0.64 -0.07 0.00 -3.03 0.00 0.00 36.82 34.46 1f88 h ILE 256 CO -0.13 0.21 0.40 0.24 -0.68 0.00 0.00 178.15 178.19 1f88 h MET 257 N 0.65 0.65 -0.56 2.37 2.86 0.34 -0.65 114.93 120.59 1f88 h MET 257 Ca 0.17 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1f88 h MET 257 Cb 0.12 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1f88 h MET 257 CO -0.02 0.43 0.12 0.28 1.06 0.00 0.00 176.91 178.78 1f88 h VAL 258 N 0.67 1.25 -0.61 -2.22 2.07 -0.93 -2.75 116.25 113.72 1f88 h VAL 258 Ca 0.38 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.90 1f88 h VAL 258 Cb 0.40 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1f88 h VAL 258 CO -0.27 0.33 0.04 0.40 0.02 0.00 0.00 177.57 178.09 1f88 h ILE 259 N 0.80 1.26 0.00 4.57 2.04 -0.52 -2.67 117.51 122.99 1f88 h ILE 259 Ca 0.17 -1.09 -0.05 0.00 1.00 0.00 0.00 64.86 64.90 1f88 h ILE 259 Cb 0.37 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1f88 h ILE 259 CO 0.00 0.40 -0.22 0.00 0.00 0.00 0.00 178.15 178.33 1f88 h ALA 260 N 1.07 1.15 -0.10 1.87 0.00 -1.09 -2.65 119.26 119.51 1f88 h ALA 260 Ca 0.18 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1f88 h ALA 260 Cb 0.50 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1f88 h ALA 260 CO 0.02 0.28 -0.41 0.35 0.00 0.00 0.00 179.25 179.49 1f88 h PHE 261 N 0.00 0.60 0.00 0.00 3.57 -1.22 -2.99 116.94 116.89 1f88 h PHE 261 Ca -0.00 -0.26 -0.02 0.00 3.53 0.00 0.00 57.97 61.22 1f88 h PHE 261 Cb 0.61 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.25 1f88 h PHE 261 CO 0.00 1.01 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.95 1f88 h LEU 262 N 0.02 0.00 -0.48 0.59 3.38 -1.17 -0.76 115.31 116.89 1f88 h LEU 262 Ca -0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 1f88 h LEU 262 Cb 1.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1f88 h LEU 262 CO 0.09 0.08 -0.68 0.40 0.09 0.00 0.00 178.44 178.41 1f88 h ILE 263 N 0.00 1.37 0.18 1.22 2.04 -1.42 0.55 117.51 121.45 1f88 h ILE 263 Ca -0.00 -2.43 -0.31 0.00 1.00 0.00 0.00 64.86 63.12 1f88 h ILE 263 Cb 0.14 2.35 0.02 0.00 -0.74 0.00 0.00 36.82 38.59 1f88 h ILE 263 CO 0.01 0.67 -1.49 0.00 0.00 0.00 0.00 178.15 177.34 1f88 n TRP 265 N -3.77 0.33 -0.08 0.00 7.02 -0.37 -4.01 117.44 116.56 1f88 n TRP 265 Ca -0.21 0.10 -0.14 0.00 -1.02 0.00 0.00 57.50 56.23 1f88 n TRP 265 Cb 1.01 -0.73 -0.05 0.00 -2.42 0.00 0.00 31.31 29.12 1f88 n TRP 265 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1f88 h LEU 266 N 0.00 0.67 -1.03 -0.99 4.07 -1.09 0.88 115.31 117.83 1f88 h LEU 266 Ca -0.08 -0.50 0.04 0.00 0.08 0.00 0.00 57.88 57.42 1f88 h LEU 266 Cb 1.22 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 42.71 1f88 h LEU 266 CO 0.01 1.04 0.65 -0.65 -1.08 0.00 0.00 178.44 178.41 1f88 h PRO 267 N 0.32 1.21 0.14 1.13 0.11 -1.77 0.18 132.00 133.32 1f88 h PRO 267 Ca 0.03 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 1f88 h PRO 267 Cb 0.87 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.71 1f88 h PRO 267 CO 0.07 0.80 -0.07 -0.92 -0.21 0.00 0.00 178.00 177.67 1f88 h TYR 268 N 1.24 -0.17 -1.11 0.65 3.20 -1.65 -2.81 116.97 116.32 1f88 h TYR 268 Ca 0.40 -0.00 0.32 0.00 3.14 0.00 0.00 58.73 62.58 1f88 h TYR 268 Cb 0.03 0.06 -0.11 0.00 1.54 0.00 0.00 36.73 38.24 1f88 h TYR 268 CO -0.00 -0.10 0.70 0.00 -1.64 0.00 0.00 178.16 177.11 1f88 h ALA 269 N -1.73 2.30 -0.09 1.82 0.00 0.79 0.44 119.26 122.79 1f88 h ALA 269 Ca -0.02 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1f88 h ALA 269 Cb 0.14 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1f88 h ALA 269 CO 0.03 -0.80 0.01 0.78 0.00 0.00 0.00 179.25 179.27 1f88 h GLY 270 N 0.31 0.17 1.25 0.00 0.00 -0.72 -1.66 103.07 102.42 1f88 h GLY 270 Ca 0.68 -0.12 -0.06 0.00 0.00 0.00 0.00 47.33 47.83 1f88 h GLY 270 CO -0.38 0.11 0.11 -2.08 0.00 0.00 0.00 176.54 174.29 1f88 h VAL 271 N -0.10 1.24 -0.04 4.60 2.07 -0.60 -1.58 116.25 121.84 1f88 h VAL 271 Ca 0.03 -0.92 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1f88 h VAL 271 Cb 0.31 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1f88 h VAL 271 CO 0.00 0.34 -0.21 0.00 0.02 0.00 0.00 177.57 177.72 1f88 h ALA 272 N 1.24 1.56 0.19 1.67 0.00 -0.14 -2.76 119.26 121.03 1f88 h ALA 272 Ca 0.18 -0.22 -0.35 0.00 0.00 0.00 0.00 54.91 54.53 1f88 h ALA 272 Cb 0.37 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1f88 h ALA 272 CO 0.01 0.32 -1.71 0.35 0.00 0.00 0.00 179.25 178.21 1f88 h PHE 273 N 0.07 0.74 -0.86 0.00 3.57 -0.87 -2.75 116.94 116.84 1f88 h PHE 273 Ca 0.01 -0.54 0.13 0.00 3.53 0.00 0.00 57.97 61.10 1f88 h PHE 273 Cb 0.42 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.04 1f88 h PHE 273 CO 0.00 1.67 0.47 -0.92 -2.23 0.00 0.00 178.31 177.30 1f88 h TYR 274 N 0.09 0.83 -0.24 0.41 3.20 -1.25 -2.03 116.97 117.98 1f88 h TYR 274 Ca -0.34 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.51 1f88 h TYR 274 Cb 2.09 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 40.12 1f88 h TYR 274 CO 0.11 0.25 -0.08 0.82 -1.64 0.00 0.00 178.16 177.61 1f88 h ILE 275 N 0.70 1.29 -0.67 1.81 2.04 -1.56 -1.68 117.51 119.45 1f88 h ILE 275 Ca 0.45 -1.12 0.08 0.00 1.00 0.00 0.00 64.86 65.28 1f88 h ILE 275 Cb 0.57 1.53 -0.07 0.00 -0.74 0.00 0.00 36.82 38.11 1f88 h ILE 275 CO -0.32 0.35 0.32 0.15 0.00 0.00 0.00 178.15 178.64 1f88 h PHE 276 N 0.20 0.58 -0.17 1.37 3.57 -1.07 -1.90 116.94 119.52 1f88 h PHE 276 Ca 0.06 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.45 1f88 h PHE 276 Cb 0.56 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.14 1f88 h PHE 276 CO 0.06 0.21 -0.43 1.79 -2.23 0.00 0.00 178.31 177.71 1f88 h THR 277 N 0.56 1.34 -1.80 4.41 1.35 -1.42 -3.31 112.91 114.05 1f88 h THR 277 Ca 0.32 -1.68 -0.72 0.00 -0.55 0.00 0.00 66.41 63.78 1f88 h THR 277 Cb 0.33 1.96 -0.24 0.00 -1.73 0.00 0.00 68.15 68.47 1f88 h THR 277 CO -0.26 0.52 1.06 1.41 -0.25 0.00 0.00 175.52 178.00 1f88 n HIS 278 N -4.24 2.62 -1.86 4.73 8.25 -0.64 -4.96 115.22 119.12 1f88 n HIS 278 Ca -0.06 -2.35 -0.36 0.00 -0.26 0.00 0.00 57.72 54.68 1f88 n HIS 278 Cb 0.55 -1.29 -0.03 0.00 1.12 0.00 0.00 29.99 30.34 1f88 n HIS 278 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1f88 s GLN 279 N -3.41 2.41 0.00 -0.41 -0.21 -0.76 -2.38 119.66 114.90 1f88 s GLN 279 Ca 0.50 0.82 0.00 0.00 0.02 0.00 0.00 55.36 56.70 1f88 s GLN 279 Cb 0.35 -4.51 0.00 0.00 1.00 0.00 0.00 33.01 29.85 1f88 s GLN 279 CO -0.28 -3.01 0.00 0.41 -2.12 0.00 0.00 175.29 170.29 1f88 n GLY 280 N 5.90 0.63 2.92 3.09 0.00 -1.26 -5.07 105.19 111.41 1f88 n GLY 280 Ca 0.28 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.09 1f88 n GLY 280 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1f88 n SER 281 N 0.00 -3.49 -2.60 1.61 2.88 -1.00 -4.68 113.62 106.35 1f88 n SER 281 Ca 0.00 -0.60 -0.34 0.00 -1.33 0.00 0.00 58.87 56.60 1f88 n SER 281 Cb 0.00 -0.82 0.03 0.00 -0.75 0.00 0.00 64.21 62.68 1f88 n SER 281 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1f88 n ASP 282 N -3.28 6.52 -4.86 -3.46 4.64 -1.26 -4.76 116.55 110.09 1f88 n ASP 282 Ca 0.09 -3.79 -0.31 0.00 -1.38 0.00 0.00 54.79 49.40 1f88 n ASP 282 Cb 0.41 -0.81 -0.01 0.00 -1.04 0.00 0.00 41.12 39.67 1f88 n ASP 282 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1f88 s PHE 283 N -3.84 3.53 0.53 -0.67 -0.12 -1.26 -5.09 117.98 111.07 1f88 s PHE 283 Ca 0.53 1.32 0.09 0.00 -0.05 0.00 0.00 56.93 58.82 1f88 s PHE 283 Cb 0.44 -2.70 0.09 0.00 -0.63 0.00 0.00 43.02 40.21 1f88 s PHE 283 CO -0.23 -0.47 0.73 0.41 -0.05 0.00 0.00 175.22 175.61 1f88 n GLY 284 N -2.06 1.97 0.18 1.99 0.00 -1.26 -4.79 105.19 101.22 1f88 n GLY 284 Ca 0.06 -2.22 -0.12 0.00 0.00 0.00 0.00 46.02 43.73 1f88 n GLY 284 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1f88 h PRO 285 N 0.00 0.57 -0.42 1.61 0.11 -1.83 -3.23 132.00 128.81 1f88 h PRO 285 Ca -0.25 -0.26 0.05 0.00 0.11 0.00 0.00 66.00 65.65 1f88 h PRO 285 Cb 1.14 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1f88 h PRO 285 CO 0.35 0.83 0.28 0.82 -0.21 0.00 0.00 178.00 180.08 1f88 h ILE 286 N 0.31 0.99 -0.88 4.15 2.04 -1.95 -3.15 117.51 119.01 1f88 h ILE 286 Ca 0.06 -0.13 0.11 0.00 1.00 0.00 0.00 64.86 65.90 1f88 h ILE 286 Cb 0.67 0.58 -0.13 0.00 -0.74 0.00 0.00 36.82 37.20 1f88 h ILE 286 CO 0.04 0.07 -0.47 0.15 0.00 0.00 0.00 178.15 177.94 1f88 h PHE 287 N 0.38 -1.41 0.00 1.37 3.57 -1.97 -2.26 116.94 116.62 1f88 h PHE 287 Ca 0.18 0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1f88 h PHE 287 Cb 0.24 0.74 0.00 0.00 2.79 0.00 0.00 35.95 39.72 1f88 h PHE 287 CO -0.00 -0.40 -0.99 -0.12 -2.23 0.00 0.00 178.31 174.57 1f88 n MET 288 N -5.38 0.45 0.14 1.11 1.56 -1.21 -4.23 117.12 109.55 1f88 n MET 288 Ca 0.05 0.06 0.05 0.00 -0.27 0.00 0.00 57.70 57.59 1f88 n MET 288 Cb 0.34 -1.71 0.51 0.00 2.15 0.00 0.00 33.22 34.52 1f88 n MET 288 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 1f88 h THR 289 N 0.00 1.08 0.12 1.12 2.02 -1.37 -2.13 112.91 113.75 1f88 h THR 289 Ca 0.00 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1f88 h THR 289 Cb 0.86 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 1f88 h THR 289 CO 0.00 0.09 -0.06 0.40 0.37 0.00 0.00 175.52 176.32 1f88 h ILE 290 N 0.23 0.79 -0.09 3.11 1.08 -1.71 -1.15 117.51 119.77 1f88 h ILE 290 Ca 0.06 -1.28 -0.03 0.00 -0.39 0.00 0.00 64.86 63.23 1f88 h ILE 290 Cb 0.07 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 1f88 h ILE 290 CO -0.01 0.23 -0.07 -0.65 -0.69 0.00 0.00 178.15 176.96 1f88 h PRO 291 N -0.93 0.13 0.01 2.37 0.11 -1.78 0.26 132.00 132.18 1f88 h PRO 291 Ca -0.02 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 65.88 1f88 h PRO 291 Cb 0.50 -0.02 0.02 0.00 0.11 0.00 0.00 31.00 31.60 1f88 h PRO 291 CO 0.03 0.22 -0.78 0.00 -0.21 0.00 0.00 178.00 177.26 1f88 h ALA 292 N 1.80 0.08 0.00 -0.75 0.00 -1.47 -2.53 119.26 116.38 1f88 h ALA 292 Ca 0.03 -0.62 -0.18 0.00 0.00 0.00 0.00 54.91 54.14 1f88 h ALA 292 Cb 0.22 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1f88 h ALA 292 CO 0.01 0.47 -0.96 0.74 0.00 0.00 0.00 179.25 179.51 1f88 h PHE 293 N 0.05 0.00 -0.20 0.00 0.04 -1.09 -3.27 116.94 112.47 1f88 h PHE 293 Ca -0.10 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.65 1f88 h PHE 293 Cb 1.47 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.62 1f88 h PHE 293 CO 0.14 0.79 0.04 0.35 -0.60 0.00 0.00 178.31 179.03 1f88 h PHE 294 N 0.00 0.33 0.00 -0.55 3.57 -1.05 -2.86 116.94 116.38 1f88 h PHE 294 Ca -0.06 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1f88 h PHE 294 Cb 1.65 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.29 1f88 h PHE 294 CO 0.00 0.44 0.32 0.00 -2.23 0.00 0.00 178.31 176.84 1f88 h ALA 295 N 0.85 1.28 0.00 2.41 0.00 -1.50 -1.73 119.26 120.57 1f88 h ALA 295 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1f88 h ALA 295 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1f88 h ALA 295 CO 0.00 -0.28 0.00 1.63 0.00 0.00 0.00 179.25 180.61 1f88 n LYS 296 N -2.48 0.09 0.00 0.00 5.02 -1.08 -2.29 118.16 117.42 1f88 n LYS 296 Ca -0.01 0.26 0.07 0.00 -2.02 0.00 0.00 58.31 56.61 1f88 n LYS 296 Cb 0.35 -1.65 0.32 0.00 -0.02 0.00 0.00 35.03 34.03 1f88 n LYS 296 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1f88 n THR 297 N -1.82 0.95 0.23 -0.18 -2.24 -0.65 -2.03 114.28 108.53 1f88 n THR 297 Ca 0.04 0.24 0.17 0.00 -2.27 0.00 0.00 64.05 62.22 1f88 n THR 297 Cb 0.25 -0.99 0.85 0.00 -2.10 0.00 0.00 70.33 68.35 1f88 n THR 297 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1f88 h SER 298 N 0.00 0.00 1.50 3.42 0.87 -1.70 0.58 113.55 118.21 1f88 h SER 298 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1f88 h SER 298 Cb 0.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1f88 h SER 298 CO 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.30 1f88 h ALA 299 N 1.81 1.00 0.00 6.23 0.00 -1.66 -3.37 119.26 123.26 1f88 h ALA 299 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1f88 h ALA 299 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1f88 h ALA 299 CO -0.00 0.00 -1.05 0.28 0.00 0.00 0.00 179.25 178.48 1f88 n VAL 300 N -2.72 0.05 -0.36 0.00 0.31 0.15 -4.82 118.33 110.95 1f88 n VAL 300 Ca 0.04 -0.03 0.03 0.00 -0.01 0.00 0.00 64.34 64.37 1f88 n VAL 300 Cb 0.42 -0.82 0.17 0.00 -0.91 0.00 0.00 33.84 32.70 1f88 n VAL 300 CO 0.00 0.00 0.00 0.10 -1.32 0.00 0.00 176.83 175.61 1f88 h TYR 301 N 0.00 1.16 0.45 3.52 -0.00 -0.36 -3.29 116.97 118.46 1f88 h TYR 301 Ca -0.02 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.73 1f88 h TYR 301 Cb 1.04 -0.38 -0.01 0.00 -0.00 0.00 0.00 36.73 37.39 1f88 h TYR 301 CO 0.00 0.59 -0.30 -0.91 -0.00 0.00 0.00 178.16 177.54 1f88 h ASN 302 N 1.13 -0.76 0.00 0.10 2.35 -1.82 -2.54 115.58 114.04 1f88 h ASN 302 Ca 0.43 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.23 1f88 h ASN 302 Cb 0.20 0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1f88 h ASN 302 CO -0.18 -0.46 0.00 -0.81 -1.65 0.00 0.00 177.43 174.32 1f88 n PRO 303 N -5.43 0.13 -0.07 0.81 -0.04 -1.24 -1.40 135.00 127.77 1f88 n PRO 303 Ca -0.11 0.01 -0.17 0.00 -0.04 0.00 0.00 63.50 63.18 1f88 n PRO 303 Cb 0.33 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.16 1f88 n PRO 303 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1f88 n VAL 304 N -1.01 1.59 0.04 0.52 0.31 -0.97 -3.74 118.33 115.07 1f88 n VAL 304 Ca 0.03 -0.66 -0.01 0.00 -0.01 0.00 0.00 64.34 63.69 1f88 n VAL 304 Cb 0.02 -1.36 0.28 0.00 -0.91 0.00 0.00 33.84 31.87 1f88 n VAL 304 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1f88 h ILE 305 N 0.03 1.22 0.67 2.52 2.04 -1.07 -2.67 117.51 120.24 1f88 h ILE 305 Ca -0.49 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 64.36 1f88 h ILE 305 Cb 2.00 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 1f88 h ILE 305 CO 0.01 0.32 -0.50 0.22 0.00 0.00 0.00 178.15 178.19 1f88 h TYR 306 N 0.40 -1.35 -0.31 1.37 3.20 -1.58 -0.95 116.97 117.75 1f88 h TYR 306 Ca 0.08 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.97 1f88 h TYR 306 Cb 0.47 0.50 -0.03 0.00 1.54 0.00 0.00 36.73 39.21 1f88 h TYR 306 CO 0.01 -0.71 0.11 0.82 -1.64 0.00 0.00 178.16 176.75 1f88 h ILE 307 N -1.13 0.92 0.04 1.81 2.04 -1.63 -3.13 117.51 116.43 1f88 h ILE 307 Ca -0.09 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1f88 h ILE 307 Cb 0.93 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 1f88 h ILE 307 CO 0.03 0.04 -0.45 0.24 0.00 0.00 0.00 178.15 178.02 1f88 h MET 308 N 0.24 -0.61 -2.25 2.37 2.86 -1.33 -3.33 114.93 112.90 1f88 h MET 308 Ca 0.14 0.04 -0.62 0.00 -2.06 0.00 0.00 59.70 57.20 1f88 h MET 308 Cb 0.10 0.14 -0.40 0.00 0.06 0.00 0.00 31.60 31.50 1f88 h MET 308 CO -0.14 -0.40 -0.43 0.00 1.06 0.00 0.00 176.91 177.00 1f88 n MET 309 N -5.46 3.52 -2.90 1.72 0.00 -0.37 -4.84 117.12 108.79 1f88 n MET 309 Ca -0.07 -4.82 -0.01 0.00 0.00 0.00 0.00 57.70 52.81 1f88 n MET 309 Cb 0.38 -2.27 0.01 0.00 0.00 0.00 0.00 33.22 31.34 1f88 n MET 309 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1f88 s ASN 310 N -3.21 -1.02 0.51 3.17 3.84 -1.19 -4.76 114.94 112.29 1f88 s ASN 310 Ca 0.48 -0.80 0.32 0.00 0.21 0.00 0.00 52.86 53.06 1f88 s ASN 310 Cb 0.28 1.32 1.44 0.00 -0.55 0.00 0.00 41.25 43.74 1f88 s ASN 310 CO -0.14 -0.08 1.80 0.11 -2.79 0.00 0.00 177.10 175.99 1f88 h LYS 311 N 5.66 0.09 0.16 0.43 1.57 -1.88 -1.88 116.57 120.73 1f88 h LYS 311 Ca 0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1f88 h LYS 311 Cb 1.17 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1f88 h LYS 311 CO 0.00 0.06 -0.08 0.37 -0.57 0.00 0.00 179.45 179.23 1f88 h GLN 312 N 0.09 -0.21 -0.08 3.15 4.15 -1.95 -2.65 115.11 117.60 1f88 h GLN 312 Ca 0.57 0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.94 1f88 h GLN 312 Cb 2.07 0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.81 1f88 h GLN 312 CO -0.08 -0.02 -0.21 0.35 -1.93 0.00 0.00 178.83 176.94 1f88 h PHE 313 N -0.36 0.37 -0.73 3.99 3.04 -1.71 -2.20 116.94 119.34 1f88 h PHE 313 Ca -0.02 -0.14 0.16 0.00 3.98 0.00 0.00 57.97 61.95 1f88 h PHE 313 Cb 0.29 -0.07 -0.12 0.00 2.56 0.00 0.00 35.95 38.61 1f88 h PHE 313 CO -0.02 0.82 0.11 -0.09 -2.02 0.00 0.00 178.31 177.11 1f88 h ARG 314 N -0.19 0.19 -0.16 1.11 2.43 -1.47 0.64 114.38 116.94 1f88 h ARG 314 Ca -0.00 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.06 1f88 h ARG 314 Cb 0.82 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1f88 h ARG 314 CO 0.05 0.13 -0.28 -0.91 -1.51 0.00 0.00 179.97 177.45 1f88 h ASN 315 N 0.20 0.52 0.54 -3.80 4.21 -1.51 -2.58 115.58 113.15 1f88 h ASN 315 Ca 0.41 -0.54 -0.06 0.00 1.21 0.00 0.00 56.30 57.32 1f88 h ASN 315 Cb 0.72 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 1f88 h ASN 315 CO -0.56 0.96 -0.28 0.00 -1.29 0.00 0.00 177.43 176.26 1f88 h MET 317 N 0.00 0.58 -0.45 0.00 1.85 0.26 -2.51 114.93 114.67 1f88 h MET 317 Ca -0.00 -0.53 0.00 0.00 -0.61 0.00 0.00 59.70 58.56 1f88 h MET 317 Cb 0.62 0.13 -0.02 0.00 0.43 0.00 0.00 31.60 32.76 1f88 h MET 317 CO 0.04 1.16 0.29 0.28 -0.40 0.00 0.00 176.91 178.27 1f88 h VAL 318 N 0.20 1.12 0.00 -5.77 2.07 -1.11 -0.99 116.25 111.77 1f88 h VAL 318 Ca -0.06 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.10 1f88 h VAL 318 Cb 1.34 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1f88 h VAL 318 CO 0.14 0.12 -0.58 0.74 0.02 0.00 0.00 177.57 178.01 1f88 h THR 319 N 0.61 1.38 0.00 2.57 2.02 -1.22 -0.15 112.91 118.12 1f88 h THR 319 Ca 0.16 -2.01 -0.11 0.00 0.77 0.00 0.00 66.41 65.22 1f88 h THR 319 Cb -0.05 2.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 1f88 h THR 319 CO -0.03 0.57 -0.54 0.74 0.37 0.00 0.00 175.52 176.63 1f88 h THR 320 N 0.00 1.17 0.00 3.16 2.02 -0.75 -2.47 112.91 116.04 1f88 h THR 320 Ca -0.01 -2.00 -0.07 0.00 0.77 0.00 0.00 66.41 65.10 1f88 h THR 320 Cb 1.05 2.15 -0.01 0.00 -1.74 0.00 0.00 68.15 69.60 1f88 h THR 320 CO 0.08 0.53 -0.50 -0.07 0.37 0.00 0.00 175.52 175.93 1f88 h LEU 321 N 0.00 0.00 0.00 2.58 3.38 -1.06 -3.37 115.31 116.85 1f88 h LEU 321 Ca -0.01 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1f88 h LEU 321 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1f88 h LEU 321 CO 0.07 0.99 0.00 0.00 0.09 0.00 0.00 178.44 179.59 1f88 n GLY 324 N -1.02 1.27 3.56 0.00 0.00 -1.15 -5.05 105.19 102.79 1f88 n GLY 324 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1f88 n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f88 s LYS 325 N 0.00 3.19 0.00 1.61 3.01 -1.26 -5.04 119.74 121.26 1f88 s LYS 325 Ca 0.00 -0.53 0.00 0.00 -1.01 0.00 0.00 55.97 54.43 1f88 s LYS 325 Cb 0.00 -4.85 0.00 0.00 -1.01 0.00 0.00 37.83 31.97 1f88 s LYS 325 CO 0.00 -2.44 0.39 0.09 0.51 0.00 0.00 175.35 173.90